N-[2-[acetyl(pyridin-2-ylmethyl)amino]ethyl]cyclopropanecarboxamide

C14H19N3O2 — CID 113055158

IUPACN-[2-[acetyl(pyridin-2-ylmethyl)amino]ethyl]cyclopropanecarboxamide
SMILESCC(=O)N(CCNC(=O)C1CC1)Cc1ccccn1
InChIInChI=1S/C14H19N3O2/c1-11(18)17(10-13-4-2-3-7-15-13)9-8-16-14(19)12-5-6-12/h2-4,7,12H,5-6,8-10H2,1H3,(H,16,19)
InChIKeyUZDGXJADXVHPJG-UHFFFAOYSA-N
MW261.32 g/mol
LogP0.96
Rot. Bonds6

About N-[2-[acetyl(pyridin-2-ylmethyl)amino]ethyl]cyclopropanecarboxamide

N-[2-[acetyl(pyridin-2-ylmethyl)amino]ethyl]cyclopropanecarboxamide (PubChem CID 113055158) has the molecular formula C14H19N3O2 and a molecular weight of 261.32 g/mol. Its IUPAC name is N-[2-[acetyl(pyridin-2-ylmethyl)amino]ethyl]cyclopropanecarboxamide.

Molecular Properties

Compound NameN-[2-[acetyl(pyridin-2-ylmethyl)amino]ethyl]cyclopropanecarboxamide
PubChem CID113055158
Molecular FormulaC14H19N3O2
Molecular Weight261.32 g/mol
Exact Mass261.15
IUPAC NameN-[2-[acetyl(pyridin-2-ylmethyl)amino]ethyl]cyclopropanecarboxamide
SMILESCC(=O)N(CCNC(=O)C1CC1)Cc1ccccn1
InChIInChI=1S/C14H19N3O2/c1-11(18)17(10-13-4-2-3-7-15-13)9-8-16-14(19)12-5-6-12/h2-4,7,12H,5-6,8-10H2,1H3,(H,16,19)
InChIKeyUZDGXJADXVHPJG-UHFFFAOYSA-N
XLogP0.96
TPSA62.30 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds6
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500261.32
LogP ≤ 50.96
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

tert-butyl N-[2-[acetyl(pyridin-2-ylmethyl)amino]ethyl]carbamate
CID 113055221
3-[acetyl(pyridin-2-ylmethyl)amino]-N-cycloheptylpropanamide
CID 113120220
N-[2-[acetyl(pyridin-2-ylmethyl)amino]ethyl]-3,4-difluorobenzamide
CID 113055209
N-[2-[acetyl(pyridin-2-ylmethyl)amino]ethyl]-2-thiophen-2-ylacetamide
CID 113055189
N-[2-[acetyl(pyridin-2-ylmethyl)amino]ethyl]-3-fluorobenzamide
CID 113055172
4-hydroxy-N-(2-pyridin-2-ylethyl)cyclohexane-1-carboxamide
CID 112530288
N-[2-[acetyl(pyridin-2-ylmethyl)amino]ethyl]-2-(3-fluorophenyl)acetamide
CID 113055213
N-pentyl-N-(pyridin-2-ylmethyl)acetamide
CID 46206176
N-(2-pyridin-2-ylethyl)cyclopentanecarboxamide
CID 110872250
3-[acetyl(pyridin-2-ylmethyl)amino]-N-pentylpropanamide
CID 113120223
3-[acetyl(pyridin-2-ylmethyl)amino]-N-prop-2-enylpropanamide
CID 113120148
2-[acetyl(pyridin-2-ylmethyl)amino]-N-cycloheptylacetamide
CID 113163426

Frequently Asked Questions

What is the IUPAC name of N-[2-[acetyl(pyridin-2-ylmethyl)amino]ethyl]cyclopropanecarboxamide?
The IUPAC name of N-[2-[acetyl(pyridin-2-ylmethyl)amino]ethyl]cyclopropanecarboxamide (CID 113055158) is N-[2-[acetyl(pyridin-2-ylmethyl)amino]ethyl]cyclopropanecarboxamide.
What is the SMILES notation for N-[2-[acetyl(pyridin-2-ylmethyl)amino]ethyl]cyclopropanecarboxamide?
The canonical SMILES for N-[2-[acetyl(pyridin-2-ylmethyl)amino]ethyl]cyclopropanecarboxamide is CC(=O)N(CCNC(=O)C1CC1)Cc1ccccn1.
What is the InChIKey of N-[2-[acetyl(pyridin-2-ylmethyl)amino]ethyl]cyclopropanecarboxamide?
The InChIKey is UZDGXJADXVHPJG-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H19N3O2/c1-11(18)17(10-13-4-2-3-7-15-13)9-8-16-14(19)12-5-6-12/h2-4,7,12H,5-6,8-10H2,1H3,(H,16,19).
What are the key properties of N-[2-[acetyl(pyridin-2-ylmethyl)amino]ethyl]cyclopropanecarboxamide?
N-[2-[acetyl(pyridin-2-ylmethyl)amino]ethyl]cyclopropanecarboxamide has a molecular weight of 261.32 g/mol, XLogP of 0.96, 6 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-[2-[acetyl(pyridin-2-ylmethyl)amino]ethyl]cyclopropanecarboxamide is sourced from PubChem (CID 113055158), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).