2-(cyclopropylmethylamino)-N-(6-imidazol-1-yl-3-pyridinyl)acetamide

C14H17N5O — CID 60867461

IUPAC2-(cyclopropylmethylamino)-N-(6-imidazol-1-yl-3-pyridinyl)acetamide
SMILESO=C(CNCC1CC1)Nc1ccc(-n2ccnc2)nc1
InChIInChI=1S/C14H17N5O/c20-14(9-16-7-11-1-2-11)18-12-3-4-13(17-8-12)19-6-5-15-10-19/h3-6,8,10-11,16H,1-2,7,9H2,(H,18,20)
InChIKeyPBGKHCAUAFVIJQ-UHFFFAOYSA-N
MW271.32 g/mol
LogP1.21
Rot. Bonds6

About 2-(cyclopropylmethylamino)-N-(6-imidazol-1-yl-3-pyridinyl)acetamide

2-(cyclopropylmethylamino)-N-(6-imidazol-1-yl-3-pyridinyl)acetamide (PubChem CID 60867461) has the molecular formula C14H17N5O and a molecular weight of 271.32 g/mol. Its IUPAC name is 2-(cyclopropylmethylamino)-N-(6-imidazol-1-yl-3-pyridinyl)acetamide.

Molecular Properties

Compound Name2-(cyclopropylmethylamino)-N-(6-imidazol-1-yl-3-pyridinyl)acetamide
PubChem CID60867461
Molecular FormulaC14H17N5O
Molecular Weight271.32 g/mol
Exact Mass271.14
IUPAC Name2-(cyclopropylmethylamino)-N-(6-imidazol-1-yl-3-pyridinyl)acetamide
SMILESO=C(CNCC1CC1)Nc1ccc(-n2ccnc2)nc1
InChIInChI=1S/C14H17N5O/c20-14(9-16-7-11-1-2-11)18-12-3-4-13(17-8-12)19-6-5-15-10-19/h3-6,8,10-11,16H,1-2,7,9H2,(H,18,20)
InChIKeyPBGKHCAUAFVIJQ-UHFFFAOYSA-N
XLogP1.21
TPSA71.84 Ų
H-Bond Donors2
H-Bond Acceptors5
Rotatable Bonds6
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500271.32
LogP ≤ 51.21
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 105

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Related Compounds

N-(6-imidazol-1-yl-3-pyridinyl)butanamide
CID 35437719
N-(cyclopropylmethyl)-6-imidazol-1-ylpyridine-3-carboxamide
CID 47152532
N-(6-bromo-3-pyridinyl)-2-(cyclopropylmethylamino)acetamide
CID 103813939
N-(6-imidazol-1-yl-3-pyridinyl)-3-[(2R)-oxolan-2-yl]propanamide
CID 94177685
ethyl 2-[(6-imidazol-1-yl-3-pyridinyl)amino]-2-oxoacetate
CID 90564814
N-(6-imidazol-1-yl-3-pyridinyl)-2-thiomorpholin-3-ylacetamide;dihydrochloride
CID 119941131
N-(6-imidazol-1-yl-3-pyridinyl)-2-morpholin-2-ylacetamide;dihydrochloride
CID 119846852
2-(cyclopropylmethylamino)-N-pyridin-3-ylacetamide;dihydrochloride
CID 119827153
N-(6-imidazol-1-yl-3-pyridinyl)-4-(methylamino)butanamide;dihydrochloride
CID 119846827
2-(cyclopropylmethylamino)-N-[(2-imidazol-1-yl-4-pyridinyl)methyl]acetamide;dihydrochloride
CID 119859974
2-(cyclopropylmethylamino)-N-[6-(diethylamino)-3-pyridinyl]acetamide;dihydrochloride
CID 119845923
N-(6-imidazol-1-yl-3-pyridinyl)pyrrolidine-3-carboxamide
CID 63005414

Frequently Asked Questions

What is the IUPAC name of 2-(cyclopropylmethylamino)-N-(6-imidazol-1-yl-3-pyridinyl)acetamide?
The IUPAC name of 2-(cyclopropylmethylamino)-N-(6-imidazol-1-yl-3-pyridinyl)acetamide (CID 60867461) is 2-(cyclopropylmethylamino)-N-(6-imidazol-1-yl-3-pyridinyl)acetamide.
What is the SMILES notation for 2-(cyclopropylmethylamino)-N-(6-imidazol-1-yl-3-pyridinyl)acetamide?
The canonical SMILES for 2-(cyclopropylmethylamino)-N-(6-imidazol-1-yl-3-pyridinyl)acetamide is O=C(CNCC1CC1)Nc1ccc(-n2ccnc2)nc1.
What is the InChIKey of 2-(cyclopropylmethylamino)-N-(6-imidazol-1-yl-3-pyridinyl)acetamide?
The InChIKey is PBGKHCAUAFVIJQ-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H17N5O/c20-14(9-16-7-11-1-2-11)18-12-3-4-13(17-8-12)19-6-5-15-10-19/h3-6,8,10-11,16H,1-2,7,9H2,(H,18,20).
What are the key properties of 2-(cyclopropylmethylamino)-N-(6-imidazol-1-yl-3-pyridinyl)acetamide?
2-(cyclopropylmethylamino)-N-(6-imidazol-1-yl-3-pyridinyl)acetamide has a molecular weight of 271.32 g/mol, XLogP of 1.21, 6 rotatable bonds, 2 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(cyclopropylmethylamino)-N-(6-imidazol-1-yl-3-pyridinyl)acetamide is sourced from PubChem (CID 60867461), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).