(2S,4S)-2-methyl-N-[[6-(2-methylmorpholin-4-yl)-3-pyridinyl]methyl]piperidine-4-carboxamide;hydrochloride

C18H29ClN4O2 — CID 120633132

IUPAC(2S,4S)-2-methyl-N-[[6-(2-methylmorpholin-4-yl)-3-pyridinyl]methyl]piperidine-4-carboxamide;hydrochloride
SMILESCC1CN(c2ccc(CNC(=O)[C@H]3CCN[C@@H](C)C3)cn2)CCO1.Cl
InChIInChI=1S/C18H28N4O2.ClH/c1-13-9-16(5-6-19-13)18(23)21-11-15-3-4-17(20-10-15)22-7-8-24-14(2)12-22;/h3-4,10,13-14,16,19H,5-9,11-12H2,1-2H3,(H,21,23);1H/t13-,14?,16-;/m0./s1
InChIKeyHEWIZKBFPBSRNT-VKDUWCACSA-N
MW368.91 g/mol
LogP1.73
Rot. Bonds4

About (2S,4S)-2-methyl-N-[[6-(2-methylmorpholin-4-yl)-3-pyridinyl]methyl]piperidine-4-carboxamide;hydrochloride

(2S,4S)-2-methyl-N-[[6-(2-methylmorpholin-4-yl)-3-pyridinyl]methyl]piperidine-4-carboxamide;hydrochloride (PubChem CID 120633132) has the molecular formula C18H29ClN4O2 and a molecular weight of 368.91 g/mol. Its IUPAC name is (2S,4S)-2-methyl-N-[[6-(2-methylmorpholin-4-yl)-3-pyridinyl]methyl]piperidine-4-carboxamide;hydrochloride.

Molecular Properties

Compound Name(2S,4S)-2-methyl-N-[[6-(2-methylmorpholin-4-yl)-3-pyridinyl]methyl]piperidine-4-carboxamide;hydrochloride
PubChem CID120633132
Molecular FormulaC18H29ClN4O2
Molecular Weight368.91 g/mol
Exact Mass368.20
IUPAC Name(2S,4S)-2-methyl-N-[[6-(2-methylmorpholin-4-yl)-3-pyridinyl]methyl]piperidine-4-carboxamide;hydrochloride
SMILESCC1CN(c2ccc(CNC(=O)[C@H]3CCN[C@@H](C)C3)cn2)CCO1.Cl
InChIInChI=1S/C18H28N4O2.ClH/c1-13-9-16(5-6-19-13)18(23)21-11-15-3-4-17(20-10-15)22-7-8-24-14(2)12-22;/h3-4,10,13-14,16,19H,5-9,11-12H2,1-2H3,(H,21,23);1H/t13-,14?,16-;/m0./s1
InChIKeyHEWIZKBFPBSRNT-VKDUWCACSA-N
XLogP1.73
TPSA66.49 Ų
H-Bond Donors2
H-Bond Acceptors5
Rotatable Bonds4
Heavy Atoms25
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500368.91
LogP ≤ 51.73
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 105

Analyze (2S,4S)-2-methyl-N-[[6-(2-methylmorpholin-4-yl)-3-pyridinyl]methyl]piperidine-4-carboxamide;hydrochloride with MolForge

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Launch Full Analysis

Related Compounds

N-[[6-(2-methylmorpholin-4-yl)-3-pyridinyl]methyl]pyrrolidine-3-carboxamide
CID 119846618
(2S,4S)-2-methyl-N-[[6-(4-methylpiperazin-1-yl)-3-pyridinyl]methyl]piperidine-4-carboxamide;hydrochloride
CID 120632053
3-amino-N-[[6-(2-methylmorpholin-4-yl)-3-pyridinyl]methyl]cyclohexane-1-carboxamide
CID 119846574
(2S,4S)-2-methyl-N-[[6-(4-methylpiperazin-1-yl)-3-pyridinyl]methyl]piperidine-4-carboxamide
CID 120632054
1-(3,5-dimethylbenzoyl)-N-[[6-(2-methylmorpholin-4-yl)-3-pyridinyl]methyl]piperidine-3-carboxamide
CID 55791220
(2S,4S)-2-methyl-N-[[6-(2-methylimidazol-1-yl)-3-pyridinyl]methyl]piperidine-4-carboxamide
CID 120633628
1-[2-(4-chlorophenyl)ethyl]-3-[[6-(2-methylmorpholin-4-yl)-3-pyridinyl]methyl]urea
CID 86992830
2-methyl-1-[[6-(2-methylmorpholin-4-yl)-3-pyridinyl]methyl]guanidine
CID 110915666
5-(2-chlorophenyl)-N-[[6-(2-methylmorpholin-4-yl)-3-pyridinyl]methyl]pyrazolidine-3-carboxamide
CID 52986431
1-(furan-3-ylmethyl)-3-[[6-[(2R)-2-methylmorpholin-4-yl]-3-pyridinyl]methyl]urea
CID 94068034
5-methyl-N-[[6-(2-methylmorpholin-4-yl)-3-pyridinyl]methyl]-4,5-dihydro-1H-imidazol-2-amine
CID 120969668
(2S)-2-amino-3,3-dimethyl-N-[[6-(2-methylmorpholin-4-yl)-3-pyridinyl]methyl]butanamide
CID 119846586

Frequently Asked Questions

What is the IUPAC name of (2S,4S)-2-methyl-N-[[6-(2-methylmorpholin-4-yl)-3-pyridinyl]methyl]piperidine-4-carboxamide;hydrochloride?
The IUPAC name of (2S,4S)-2-methyl-N-[[6-(2-methylmorpholin-4-yl)-3-pyridinyl]methyl]piperidine-4-carboxamide;hydrochloride (CID 120633132) is (2S,4S)-2-methyl-N-[[6-(2-methylmorpholin-4-yl)-3-pyridinyl]methyl]piperidine-4-carboxamide;hydrochloride.
What is the SMILES notation for (2S,4S)-2-methyl-N-[[6-(2-methylmorpholin-4-yl)-3-pyridinyl]methyl]piperidine-4-carboxamide;hydrochloride?
The canonical SMILES for (2S,4S)-2-methyl-N-[[6-(2-methylmorpholin-4-yl)-3-pyridinyl]methyl]piperidine-4-carboxamide;hydrochloride is CC1CN(c2ccc(CNC(=O)[C@H]3CCN[C@@H](C)C3)cn2)CCO1.Cl.
What is the InChIKey of (2S,4S)-2-methyl-N-[[6-(2-methylmorpholin-4-yl)-3-pyridinyl]methyl]piperidine-4-carboxamide;hydrochloride?
The InChIKey is HEWIZKBFPBSRNT-VKDUWCACSA-N. The full InChI is InChI=1S/C18H28N4O2.ClH/c1-13-9-16(5-6-19-13)18(23)21-11-15-3-4-17(20-10-15)22-7-8-24-14(2)12-22;/h3-4,10,13-14,16,19H,5-9,11-12H2,1-2H3,(H,21,23);1H/t13-,14?,16-;/m0./s1.
What are the key properties of (2S,4S)-2-methyl-N-[[6-(2-methylmorpholin-4-yl)-3-pyridinyl]methyl]piperidine-4-carboxamide;hydrochloride?
(2S,4S)-2-methyl-N-[[6-(2-methylmorpholin-4-yl)-3-pyridinyl]methyl]piperidine-4-carboxamide;hydrochloride has a molecular weight of 368.91 g/mol, XLogP of 1.73, 4 rotatable bonds, 2 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for (2S,4S)-2-methyl-N-[[6-(2-methylmorpholin-4-yl)-3-pyridinyl]methyl]piperidine-4-carboxamide;hydrochloride is sourced from PubChem (CID 120633132), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).