4-(dimethylamino)-N-[(2S)-2-[(2-imidazo[1,2-a]pyridin-2-ylacetyl)amino]propyl]pentanamide

C19H29N5O2 — CID 166370812

IUPAC4-(dimethylamino)-N-[(2S)-2-[(2-imidazo[1,2-a]pyridin-2-ylacetyl)amino]propyl]pentanamide
SMILESCC(CCC(=O)NC[C@H](C)NC(=O)Cc1cn2ccccc2n1)N(C)C
InChIInChI=1S/C19H29N5O2/c1-14(12-20-18(25)9-8-15(2)23(3)4)21-19(26)11-16-13-24-10-6-5-7-17(24)22-16/h5-7,10,13-15H,8-9,11-12H2,1-4H3,(H,20,25)(H,21,26)/t14-,15?/m0/s1
InChIKeySUWZAQILZHJEIL-MLCCFXAWSA-N
MW359.47 g/mol
LogP1.23
Rot. Bonds9

About 4-(dimethylamino)-N-[(2S)-2-[(2-imidazo[1,2-a]pyridin-2-ylacetyl)amino]propyl]pentanamide

4-(dimethylamino)-N-[(2S)-2-[(2-imidazo[1,2-a]pyridin-2-ylacetyl)amino]propyl]pentanamide (PubChem CID 166370812) has the molecular formula C19H29N5O2 and a molecular weight of 359.47 g/mol. Its IUPAC name is 4-(dimethylamino)-N-[(2S)-2-[(2-imidazo[1,2-a]pyridin-2-ylacetyl)amino]propyl]pentanamide.

Molecular Properties

Compound Name4-(dimethylamino)-N-[(2S)-2-[(2-imidazo[1,2-a]pyridin-2-ylacetyl)amino]propyl]pentanamide
PubChem CID166370812
Molecular FormulaC19H29N5O2
Molecular Weight359.47 g/mol
Exact Mass359.23
IUPAC Name4-(dimethylamino)-N-[(2S)-2-[(2-imidazo[1,2-a]pyridin-2-ylacetyl)amino]propyl]pentanamide
SMILESCC(CCC(=O)NC[C@H](C)NC(=O)Cc1cn2ccccc2n1)N(C)C
InChIInChI=1S/C19H29N5O2/c1-14(12-20-18(25)9-8-15(2)23(3)4)21-19(26)11-16-13-24-10-6-5-7-17(24)22-16/h5-7,10,13-15H,8-9,11-12H2,1-4H3,(H,20,25)(H,21,26)/t14-,15?/m0/s1
InChIKeySUWZAQILZHJEIL-MLCCFXAWSA-N
XLogP1.23
TPSA78.74 Ų
H-Bond Donors2
H-Bond Acceptors5
Rotatable Bonds9
Heavy Atoms26
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500359.47
LogP ≤ 51.23
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 105

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Frequently Asked Questions

What is the IUPAC name of 4-(dimethylamino)-N-[(2S)-2-[(2-imidazo[1,2-a]pyridin-2-ylacetyl)amino]propyl]pentanamide?
The IUPAC name of 4-(dimethylamino)-N-[(2S)-2-[(2-imidazo[1,2-a]pyridin-2-ylacetyl)amino]propyl]pentanamide (CID 166370812) is 4-(dimethylamino)-N-[(2S)-2-[(2-imidazo[1,2-a]pyridin-2-ylacetyl)amino]propyl]pentanamide.
What is the SMILES notation for 4-(dimethylamino)-N-[(2S)-2-[(2-imidazo[1,2-a]pyridin-2-ylacetyl)amino]propyl]pentanamide?
The canonical SMILES for 4-(dimethylamino)-N-[(2S)-2-[(2-imidazo[1,2-a]pyridin-2-ylacetyl)amino]propyl]pentanamide is CC(CCC(=O)NC[C@H](C)NC(=O)Cc1cn2ccccc2n1)N(C)C.
What is the InChIKey of 4-(dimethylamino)-N-[(2S)-2-[(2-imidazo[1,2-a]pyridin-2-ylacetyl)amino]propyl]pentanamide?
The InChIKey is SUWZAQILZHJEIL-MLCCFXAWSA-N. The full InChI is InChI=1S/C19H29N5O2/c1-14(12-20-18(25)9-8-15(2)23(3)4)21-19(26)11-16-13-24-10-6-5-7-17(24)22-16/h5-7,10,13-15H,8-9,11-12H2,1-4H3,(H,20,25)(H,21,26)/t14-,15?/m0/s1.
What are the key properties of 4-(dimethylamino)-N-[(2S)-2-[(2-imidazo[1,2-a]pyridin-2-ylacetyl)amino]propyl]pentanamide?
4-(dimethylamino)-N-[(2S)-2-[(2-imidazo[1,2-a]pyridin-2-ylacetyl)amino]propyl]pentanamide has a molecular weight of 359.47 g/mol, XLogP of 1.23, 9 rotatable bonds, 2 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 4-(dimethylamino)-N-[(2S)-2-[(2-imidazo[1,2-a]pyridin-2-ylacetyl)amino]propyl]pentanamide is sourced from PubChem (CID 166370812), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).