(2S)-2-ethyl-2-methyl-N-[1-(6-methyl-2-pyridinyl)piperidin-4-yl]morpholine-4-carboxamide

C19H30N4O2 — CID 99824847

IUPAC(2S)-2-ethyl-2-methyl-N-[1-(6-methyl-2-pyridinyl)piperidin-4-yl]morpholine-4-carboxamide
SMILESCC[C@@]1(C)CN(C(=O)NC2CCN(c3cccc(C)n3)CC2)CCO1
InChIInChI=1S/C19H30N4O2/c1-4-19(3)14-23(12-13-25-19)18(24)21-16-8-10-22(11-9-16)17-7-5-6-15(2)20-17/h5-7,16H,4,8-14H2,1-3H3,(H,21,24)/t19-/m0/s1
InChIKeyRVFJBIHVOXIPST-IBGZPJMESA-N
MW346.47 g/mol
LogP2.57
Rot. Bonds3

About (2S)-2-ethyl-2-methyl-N-[1-(6-methyl-2-pyridinyl)piperidin-4-yl]morpholine-4-carboxamide

(2S)-2-ethyl-2-methyl-N-[1-(6-methyl-2-pyridinyl)piperidin-4-yl]morpholine-4-carboxamide (PubChem CID 99824847) has the molecular formula C19H30N4O2 and a molecular weight of 346.47 g/mol. Its IUPAC name is (2S)-2-ethyl-2-methyl-N-[1-(6-methyl-2-pyridinyl)piperidin-4-yl]morpholine-4-carboxamide.

Molecular Properties

Compound Name(2S)-2-ethyl-2-methyl-N-[1-(6-methyl-2-pyridinyl)piperidin-4-yl]morpholine-4-carboxamide
PubChem CID99824847
Molecular FormulaC19H30N4O2
Molecular Weight346.47 g/mol
Exact Mass346.24
IUPAC Name(2S)-2-ethyl-2-methyl-N-[1-(6-methyl-2-pyridinyl)piperidin-4-yl]morpholine-4-carboxamide
SMILESCC[C@@]1(C)CN(C(=O)NC2CCN(c3cccc(C)n3)CC2)CCO1
InChIInChI=1S/C19H30N4O2/c1-4-19(3)14-23(12-13-25-19)18(24)21-16-8-10-22(11-9-16)17-7-5-6-15(2)20-17/h5-7,16H,4,8-14H2,1-3H3,(H,21,24)/t19-/m0/s1
InChIKeyRVFJBIHVOXIPST-IBGZPJMESA-N
XLogP2.57
TPSA57.70 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds3
Heavy Atoms25
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500346.47
LogP ≤ 52.57
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Related Compounds

2,2-dimethyl-N-(6-methyl-4-(morpholinomethyl)pyridin-2-yl)butanamide
CID 24956409
(S)-1-(4-(6-acetyl-4-(3-methylmorpholino)-5,6,7,8-tetrahydropyrido[4,3-d]pyrimidin-2-yl)phenyl)-3-ethylurea
CID 59239336
N-[(4-piperazin-1-yloxan-4-yl)methyl]-N-[6-(trifluoromethyl)pyridin-2-yl]propanamide
CID 126539128
N-(6-methyl-2-pyridinyl)-4-morpholin-4-yl-4-oxobutanamide
CID 25162582
2,2-dimethyl-N-(5-methyl-6-(morpholinomethyl)pyridin-2-yl)butanamide
CID 24956413
N-(3,4-difluorophenyl)-4-[(6-methyl-2-pyridinyl)amino]piperidine-1-carboxamide
CID 53621814
N-[2-[1-(6-Methyl-2-pyridinyl)-4-piperidinyl]ethyl]carbamic acid 2-(methylamino)-2-oxoethyl ester
CID 9840648
Tert-butyl 4-(5,6,7,8-tetrahydro-1,8-naphthyridin-2-yl)piperidine-1-carboxylate
CID 11197916
(6-(Morpholin-4-yl)pyridin-2-yl)methanamine
CID 18525737
Tert-butyl 4-(6-(aminomethyl)pyridin-2-yl)piperazine-1-carboxylate
CID 112694258
4-(6-Heptyl-2-pyridinyl)morpholine
CID 14570978
1-(3-Methoxypropyl)-3-[[6-(2-methylmorpholin-4-yl)-3-pyridinyl]methyl]urea
CID 45825820

Frequently Asked Questions

What is the IUPAC name of (2S)-2-ethyl-2-methyl-N-[1-(6-methyl-2-pyridinyl)piperidin-4-yl]morpholine-4-carboxamide?
The IUPAC name of (2S)-2-ethyl-2-methyl-N-[1-(6-methyl-2-pyridinyl)piperidin-4-yl]morpholine-4-carboxamide (CID 99824847) is (2S)-2-ethyl-2-methyl-N-[1-(6-methyl-2-pyridinyl)piperidin-4-yl]morpholine-4-carboxamide.
What is the SMILES notation for (2S)-2-ethyl-2-methyl-N-[1-(6-methyl-2-pyridinyl)piperidin-4-yl]morpholine-4-carboxamide?
The canonical SMILES for (2S)-2-ethyl-2-methyl-N-[1-(6-methyl-2-pyridinyl)piperidin-4-yl]morpholine-4-carboxamide is CC[C@@]1(C)CN(C(=O)NC2CCN(c3cccc(C)n3)CC2)CCO1.
What is the InChIKey of (2S)-2-ethyl-2-methyl-N-[1-(6-methyl-2-pyridinyl)piperidin-4-yl]morpholine-4-carboxamide?
The InChIKey is RVFJBIHVOXIPST-IBGZPJMESA-N. The full InChI is InChI=1S/C19H30N4O2/c1-4-19(3)14-23(12-13-25-19)18(24)21-16-8-10-22(11-9-16)17-7-5-6-15(2)20-17/h5-7,16H,4,8-14H2,1-3H3,(H,21,24)/t19-/m0/s1.
What are the key properties of (2S)-2-ethyl-2-methyl-N-[1-(6-methyl-2-pyridinyl)piperidin-4-yl]morpholine-4-carboxamide?
(2S)-2-ethyl-2-methyl-N-[1-(6-methyl-2-pyridinyl)piperidin-4-yl]morpholine-4-carboxamide has a molecular weight of 346.47 g/mol, XLogP of 2.57, 3 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for (2S)-2-ethyl-2-methyl-N-[1-(6-methyl-2-pyridinyl)piperidin-4-yl]morpholine-4-carboxamide is sourced from PubChem (CID 99824847), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).