(2S,4S)-N-[[1-(2-methoxyethyl)cyclopropyl]methyl]-2-methylpiperidine-4-carboxamide

C14H26N2O2 — CID 120639460

IUPAC(2S,4S)-N-[[1-(2-methoxyethyl)cyclopropyl]methyl]-2-methylpiperidine-4-carboxamide
SMILESCOCCC1(CNC(=O)[C@H]2CCN[C@@H](C)C2)CC1
InChIInChI=1S/C14H26N2O2/c1-11-9-12(3-7-15-11)13(17)16-10-14(4-5-14)6-8-18-2/h11-12,15H,3-10H2,1-2H3,(H,16,17)/t11-,12-/m0/s1
InChIKeyUQSNLOJJCOPWHF-RYUDHWBXSA-N
MW254.37 g/mol
LogP1.31
Rot. Bonds6

About (2S,4S)-N-[[1-(2-methoxyethyl)cyclopropyl]methyl]-2-methylpiperidine-4-carboxamide

(2S,4S)-N-[[1-(2-methoxyethyl)cyclopropyl]methyl]-2-methylpiperidine-4-carboxamide (PubChem CID 120639460) has the molecular formula C14H26N2O2 and a molecular weight of 254.37 g/mol. Its IUPAC name is (2S,4S)-N-[[1-(2-methoxyethyl)cyclopropyl]methyl]-2-methylpiperidine-4-carboxamide.

Molecular Properties

Compound Name(2S,4S)-N-[[1-(2-methoxyethyl)cyclopropyl]methyl]-2-methylpiperidine-4-carboxamide
PubChem CID120639460
Molecular FormulaC14H26N2O2
Molecular Weight254.37 g/mol
Exact Mass254.20
IUPAC Name(2S,4S)-N-[[1-(2-methoxyethyl)cyclopropyl]methyl]-2-methylpiperidine-4-carboxamide
SMILESCOCCC1(CNC(=O)[C@H]2CCN[C@@H](C)C2)CC1
InChIInChI=1S/C14H26N2O2/c1-11-9-12(3-7-15-11)13(17)16-10-14(4-5-14)6-8-18-2/h11-12,15H,3-10H2,1-2H3,(H,16,17)/t11-,12-/m0/s1
InChIKeyUQSNLOJJCOPWHF-RYUDHWBXSA-N
XLogP1.31
TPSA50.36 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds6
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500254.37
LogP ≤ 51.31
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Related Compounds

(2S)-2-methyl-N-[(4-methyloxan-4-yl)methyl]pentanamide
CID 99740333
3-methyl-N-[(3S)-7-oxaspiro[3.5]nonan-3-yl]butanamide
CID 164634508
1-(2-methylpropyl)-N-piperidin-4-ylcyclopropane-1-carboxamide
CID 57700548
N-(oxan-4-yl)-6-azaspiro[2.5]octane-2-carboxamide
CID 64070340
(3R)-3-amino-4-methyl-N-(oxan-4-ylmethyl)hexanamide
CID 67291396
4-methyl-N-(oxan-4-ylmethyl)-1-propan-2-ylpiperidine-4-carboxamide
CID 134557458
4-tert-butyl-N-cyclopropyloxane-4-carboxamide
CID 140911436
2,2,4,4-tetramethyl-N-(oxan-4-ylmethyl)pentanamide
CID 145047372
N-[1-(4-ethoxybutyl)piperidin-4-yl]-1-propan-2-ylcyclopropane-1-carboxamide;molecular hydrogen
CID 156819591
3,3,5-trimethyl-N-(oxan-4-ylmethyl)hexanamide
CID 159183897
N-(2-ethyl-4-methoxybutanoyl)-6-azaspiro[2.5]octane-2-carboxamide
CID 163299163
1-[[1-(methoxymethyl)cyclopropyl]methyl]-N-propan-2-ylpiperidine-4-carboxamide
CID 170276309

Frequently Asked Questions

What is the IUPAC name of (2S,4S)-N-[[1-(2-methoxyethyl)cyclopropyl]methyl]-2-methylpiperidine-4-carboxamide?
The IUPAC name of (2S,4S)-N-[[1-(2-methoxyethyl)cyclopropyl]methyl]-2-methylpiperidine-4-carboxamide (CID 120639460) is (2S,4S)-N-[[1-(2-methoxyethyl)cyclopropyl]methyl]-2-methylpiperidine-4-carboxamide.
What is the SMILES notation for (2S,4S)-N-[[1-(2-methoxyethyl)cyclopropyl]methyl]-2-methylpiperidine-4-carboxamide?
The canonical SMILES for (2S,4S)-N-[[1-(2-methoxyethyl)cyclopropyl]methyl]-2-methylpiperidine-4-carboxamide is COCCC1(CNC(=O)[C@H]2CCN[C@@H](C)C2)CC1.
What is the InChIKey of (2S,4S)-N-[[1-(2-methoxyethyl)cyclopropyl]methyl]-2-methylpiperidine-4-carboxamide?
The InChIKey is UQSNLOJJCOPWHF-RYUDHWBXSA-N. The full InChI is InChI=1S/C14H26N2O2/c1-11-9-12(3-7-15-11)13(17)16-10-14(4-5-14)6-8-18-2/h11-12,15H,3-10H2,1-2H3,(H,16,17)/t11-,12-/m0/s1.
What are the key properties of (2S,4S)-N-[[1-(2-methoxyethyl)cyclopropyl]methyl]-2-methylpiperidine-4-carboxamide?
(2S,4S)-N-[[1-(2-methoxyethyl)cyclopropyl]methyl]-2-methylpiperidine-4-carboxamide has a molecular weight of 254.37 g/mol, XLogP of 1.31, 6 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for (2S,4S)-N-[[1-(2-methoxyethyl)cyclopropyl]methyl]-2-methylpiperidine-4-carboxamide is sourced from PubChem (CID 120639460), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).