(2R)-2-imidazol-1-yl-N-(6-pyrrolidin-1-yl-3-pyridinyl)propanamide

C15H19N5O — CID 94068119

IUPAC(2R)-2-imidazol-1-yl-N-(6-pyrrolidin-1-yl-3-pyridinyl)propanamide
SMILESC[C@H](C(=O)Nc1ccc(N2CCCC2)nc1)n1ccnc1
InChIInChI=1S/C15H19N5O/c1-12(20-9-6-16-11-20)15(21)18-13-4-5-14(17-10-13)19-7-2-3-8-19/h4-6,9-12H,2-3,7-8H2,1H3,(H,18,21)/t12-/m1/s1
InChIKeyATTWQLDQOOANST-GFCCVEGCSA-N
MW285.35 g/mol
LogP2.08
Rot. Bonds4

About (2R)-2-imidazol-1-yl-N-(6-pyrrolidin-1-yl-3-pyridinyl)propanamide

(2R)-2-imidazol-1-yl-N-(6-pyrrolidin-1-yl-3-pyridinyl)propanamide (PubChem CID 94068119) has the molecular formula C15H19N5O and a molecular weight of 285.35 g/mol. Its IUPAC name is (2R)-2-imidazol-1-yl-N-(6-pyrrolidin-1-yl-3-pyridinyl)propanamide.

Molecular Properties

Compound Name(2R)-2-imidazol-1-yl-N-(6-pyrrolidin-1-yl-3-pyridinyl)propanamide
PubChem CID94068119
Molecular FormulaC15H19N5O
Molecular Weight285.35 g/mol
Exact Mass285.16
IUPAC Name(2R)-2-imidazol-1-yl-N-(6-pyrrolidin-1-yl-3-pyridinyl)propanamide
SMILESC[C@H](C(=O)Nc1ccc(N2CCCC2)nc1)n1ccnc1
InChIInChI=1S/C15H19N5O/c1-12(20-9-6-16-11-20)15(21)18-13-4-5-14(17-10-13)19-7-2-3-8-19/h4-6,9-12H,2-3,7-8H2,1H3,(H,18,21)/t12-/m1/s1
InChIKeyATTWQLDQOOANST-GFCCVEGCSA-N
XLogP2.08
TPSA63.05 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds4
Heavy Atoms21
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500285.35
LogP ≤ 52.08
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

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Frequently Asked Questions

What is the IUPAC name of (2R)-2-imidazol-1-yl-N-(6-pyrrolidin-1-yl-3-pyridinyl)propanamide?
The IUPAC name of (2R)-2-imidazol-1-yl-N-(6-pyrrolidin-1-yl-3-pyridinyl)propanamide (CID 94068119) is (2R)-2-imidazol-1-yl-N-(6-pyrrolidin-1-yl-3-pyridinyl)propanamide.
What is the SMILES notation for (2R)-2-imidazol-1-yl-N-(6-pyrrolidin-1-yl-3-pyridinyl)propanamide?
The canonical SMILES for (2R)-2-imidazol-1-yl-N-(6-pyrrolidin-1-yl-3-pyridinyl)propanamide is C[C@H](C(=O)Nc1ccc(N2CCCC2)nc1)n1ccnc1.
What is the InChIKey of (2R)-2-imidazol-1-yl-N-(6-pyrrolidin-1-yl-3-pyridinyl)propanamide?
The InChIKey is ATTWQLDQOOANST-GFCCVEGCSA-N. The full InChI is InChI=1S/C15H19N5O/c1-12(20-9-6-16-11-20)15(21)18-13-4-5-14(17-10-13)19-7-2-3-8-19/h4-6,9-12H,2-3,7-8H2,1H3,(H,18,21)/t12-/m1/s1.
What are the key properties of (2R)-2-imidazol-1-yl-N-(6-pyrrolidin-1-yl-3-pyridinyl)propanamide?
(2R)-2-imidazol-1-yl-N-(6-pyrrolidin-1-yl-3-pyridinyl)propanamide has a molecular weight of 285.35 g/mol, XLogP of 2.08, 4 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for (2R)-2-imidazol-1-yl-N-(6-pyrrolidin-1-yl-3-pyridinyl)propanamide is sourced from PubChem (CID 94068119), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).