(2S)-2-amino-N-cyclopropyl-4-methyl-N-(pyridin-2-ylmethyl)pentanamide

C15H23N3O — CID 61165416

IUPAC(2S)-2-amino-N-cyclopropyl-4-methyl-N-(pyridin-2-ylmethyl)pentanamide
SMILESCC(C)C[C@H](N)C(=O)N(Cc1ccccn1)C1CC1
InChIInChI=1S/C15H23N3O/c1-11(2)9-14(16)15(19)18(13-6-7-13)10-12-5-3-4-8-17-12/h3-5,8,11,13-14H,6-7,9-10,16H2,1-2H3/t14-/m0/s1
InChIKeyLFRCTGATNHXOGY-AWEZNQCLSA-N
MW261.37 g/mol
LogP1.95
Rot. Bonds6

About (2S)-2-amino-N-cyclopropyl-4-methyl-N-(pyridin-2-ylmethyl)pentanamide

(2S)-2-amino-N-cyclopropyl-4-methyl-N-(pyridin-2-ylmethyl)pentanamide (PubChem CID 61165416) has the molecular formula C15H23N3O and a molecular weight of 261.37 g/mol. Its IUPAC name is (2S)-2-amino-N-cyclopropyl-4-methyl-N-(pyridin-2-ylmethyl)pentanamide.

Molecular Properties

Compound Name(2S)-2-amino-N-cyclopropyl-4-methyl-N-(pyridin-2-ylmethyl)pentanamide
PubChem CID61165416
Molecular FormulaC15H23N3O
Molecular Weight261.37 g/mol
Exact Mass261.18
IUPAC Name(2S)-2-amino-N-cyclopropyl-4-methyl-N-(pyridin-2-ylmethyl)pentanamide
SMILESCC(C)C[C@H](N)C(=O)N(Cc1ccccn1)C1CC1
InChIInChI=1S/C15H23N3O/c1-11(2)9-14(16)15(19)18(13-6-7-13)10-12-5-3-4-8-17-12/h3-5,8,11,13-14H,6-7,9-10,16H2,1-2H3/t14-/m0/s1
InChIKeyLFRCTGATNHXOGY-AWEZNQCLSA-N
XLogP1.95
TPSA59.22 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds6
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500261.37
LogP ≤ 51.95
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

2-amino-N-cyclopropyl-3-methyl-N-(pyridin-2-ylmethyl)butanamide
CID 54869781
2-amino-N-cyclopropyl-4-methoxy-N-(pyridin-2-ylmethyl)butanamide
CID 62474295
3-amino-N-cyclopropyl-2-methyl-N-(pyridin-2-ylmethyl)propanamide
CID 62670174
2-bromo-N-cyclopropyl-N-(pyridin-2-ylmethyl)propanamide
CID 107904243
2-amino-N-cyclopropyl-3,3-dimethyl-N-(pyridin-2-ylmethyl)butanamide
CID 76895282
4-amino-N-cyclopropyl-2-methyl-N-(pyridin-2-ylmethyl)butanamide
CID 80543102
N-cyclopropyl-N-(pyridin-2-ylmethyl)propanamide
CID 60668331
2-amino-N-cyclopropyl-4-methyl-N-[(1-methylimidazol-2-yl)methyl]pentanamide
CID 54871592
ethyl N-cyclopropyl-N-(pyridin-2-ylmethyl)carbamate
CID 60665020
(2S)-2-amino-N-cyclopropyl-4-methyl-N-[(4-methylphenyl)methyl]pentanamide
CID 61165448
N-cyclopropyl-2-(4-phenylphenoxy)-N-(pyridin-2-ylmethyl)propanamide
CID 55607567
cis-(1R,2S)-N-cyclopropyl-2-methyl-N-(pyridin-2-ylmethyl)cyclopropane-1-carboxamide
CID 94822499

Frequently Asked Questions

What is the IUPAC name of (2S)-2-amino-N-cyclopropyl-4-methyl-N-(pyridin-2-ylmethyl)pentanamide?
The IUPAC name of (2S)-2-amino-N-cyclopropyl-4-methyl-N-(pyridin-2-ylmethyl)pentanamide (CID 61165416) is (2S)-2-amino-N-cyclopropyl-4-methyl-N-(pyridin-2-ylmethyl)pentanamide.
What is the SMILES notation for (2S)-2-amino-N-cyclopropyl-4-methyl-N-(pyridin-2-ylmethyl)pentanamide?
The canonical SMILES for (2S)-2-amino-N-cyclopropyl-4-methyl-N-(pyridin-2-ylmethyl)pentanamide is CC(C)C[C@H](N)C(=O)N(Cc1ccccn1)C1CC1.
What is the InChIKey of (2S)-2-amino-N-cyclopropyl-4-methyl-N-(pyridin-2-ylmethyl)pentanamide?
The InChIKey is LFRCTGATNHXOGY-AWEZNQCLSA-N. The full InChI is InChI=1S/C15H23N3O/c1-11(2)9-14(16)15(19)18(13-6-7-13)10-12-5-3-4-8-17-12/h3-5,8,11,13-14H,6-7,9-10,16H2,1-2H3/t14-/m0/s1.
What are the key properties of (2S)-2-amino-N-cyclopropyl-4-methyl-N-(pyridin-2-ylmethyl)pentanamide?
(2S)-2-amino-N-cyclopropyl-4-methyl-N-(pyridin-2-ylmethyl)pentanamide has a molecular weight of 261.37 g/mol, XLogP of 1.95, 6 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for (2S)-2-amino-N-cyclopropyl-4-methyl-N-(pyridin-2-ylmethyl)pentanamide is sourced from PubChem (CID 61165416), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).