N-[(6S)-5,6,7,8-tetrahydroimidazo[1,2-a]pyridin-6-yl]-2-[4-(tetrazol-1-yl)phenyl]acetamide

C16H17N7O — CID 95139320

IUPACN-[(6S)-5,6,7,8-tetrahydroimidazo[1,2-a]pyridin-6-yl]-2-[4-(tetrazol-1-yl)phenyl]acetamide
SMILESO=C(Cc1ccc(-n2cnnn2)cc1)N[C@H]1CCc2nccn2C1
InChIInChI=1S/C16H17N7O/c24-16(19-13-3-6-15-17-7-8-22(15)10-13)9-12-1-4-14(5-2-12)23-11-18-20-21-23/h1-2,4-5,7-8,11,13H,3,6,9-10H2,(H,19,24)/t13-/m0/s1
InChIKeyZPCBVKZWSVXLMK-ZDUSSCGKSA-N
MW323.36 g/mol
LogP0.53
Rot. Bonds4

About N-[(6S)-5,6,7,8-tetrahydroimidazo[1,2-a]pyridin-6-yl]-2-[4-(tetrazol-1-yl)phenyl]acetamide

N-[(6S)-5,6,7,8-tetrahydroimidazo[1,2-a]pyridin-6-yl]-2-[4-(tetrazol-1-yl)phenyl]acetamide (PubChem CID 95139320) has the molecular formula C16H17N7O and a molecular weight of 323.36 g/mol. Its IUPAC name is N-[(6S)-5,6,7,8-tetrahydroimidazo[1,2-a]pyridin-6-yl]-2-[4-(tetrazol-1-yl)phenyl]acetamide.

Molecular Properties

Compound NameN-[(6S)-5,6,7,8-tetrahydroimidazo[1,2-a]pyridin-6-yl]-2-[4-(tetrazol-1-yl)phenyl]acetamide
PubChem CID95139320
Molecular FormulaC16H17N7O
Molecular Weight323.36 g/mol
Exact Mass323.15
IUPAC NameN-[(6S)-5,6,7,8-tetrahydroimidazo[1,2-a]pyridin-6-yl]-2-[4-(tetrazol-1-yl)phenyl]acetamide
SMILESO=C(Cc1ccc(-n2cnnn2)cc1)N[C@H]1CCc2nccn2C1
InChIInChI=1S/C16H17N7O/c24-16(19-13-3-6-15-17-7-8-22(15)10-13)9-12-1-4-14(5-2-12)23-11-18-20-21-23/h1-2,4-5,7-8,11,13H,3,6,9-10H2,(H,19,24)/t13-/m0/s1
InChIKeyZPCBVKZWSVXLMK-ZDUSSCGKSA-N
XLogP0.53
TPSA90.52 Ų
H-Bond Donors1
H-Bond Acceptors7
Rotatable Bonds4
Heavy Atoms24
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500323.36
LogP ≤ 50.53
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 107

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Related Compounds

N-pyrrolidin-3-yl-2-[4-(tetrazol-1-yl)phenyl]acetamide
CID 119453289
2-(4-ethylsulfonylphenyl)-N-[(6R)-5,6,7,8-tetrahydroimidazo[1,2-a]pyridin-6-yl]acetamide
CID 95740566
2-(2,3-dihydro-1H-inden-5-yl)-N-[(6S)-5,6,7,8-tetrahydroimidazo[1,2-a]pyridin-6-yl]acetamide
CID 95765542
2-(2,3-dihydro-1H-inden-5-yl)-N-[(6R)-5,6,7,8-tetrahydroimidazo[1,2-a]pyridin-6-yl]acetamide
CID 95765541
2-methoxy-N-(5,6,7,8-tetrahydroimidazo[1,2-a]pyridin-6-yl)acetamide
CID 86771999
1-(6,8-dihydro-5H-imidazo[1,2-a]pyrazin-7-yl)-2-[4-(tetrazol-1-yl)phenyl]ethanone
CID 136525663
N-[(1R,2S)-2-(cycloheptylamino)cyclobutyl]-2-[4-(tetrazol-1-yl)phenyl]acetamide
CID 133138790
N-carbamoyl-4-[[2-[4-(tetrazol-1-yl)phenyl]acetyl]amino]cyclohexane-1-carboxamide
CID 167935083
1-(4-fluorophenyl)-N-[(6S)-5,6,7,8-tetrahydroimidazo[1,2-a]pyridin-6-yl]pyrazole-3-carboxamide
CID 95137538
N-[1-(4-chlorophenyl)-2-oxopyrrolidin-3-yl]-2-[4-(tetrazol-1-yl)phenyl]acetamide
CID 154748978
1-[(3R)-3-hydroxypyrrolidin-1-yl]-2-[4-(tetrazol-1-yl)phenyl]ethanone
CID 111561769
2-[(2R)-oxolan-2-yl]-N-[(6R)-5,6,7,8-tetrahydroimidazo[1,2-a]pyridin-6-yl]acetamide
CID 95765472

Frequently Asked Questions

What is the IUPAC name of N-[(6S)-5,6,7,8-tetrahydroimidazo[1,2-a]pyridin-6-yl]-2-[4-(tetrazol-1-yl)phenyl]acetamide?
The IUPAC name of N-[(6S)-5,6,7,8-tetrahydroimidazo[1,2-a]pyridin-6-yl]-2-[4-(tetrazol-1-yl)phenyl]acetamide (CID 95139320) is N-[(6S)-5,6,7,8-tetrahydroimidazo[1,2-a]pyridin-6-yl]-2-[4-(tetrazol-1-yl)phenyl]acetamide.
What is the SMILES notation for N-[(6S)-5,6,7,8-tetrahydroimidazo[1,2-a]pyridin-6-yl]-2-[4-(tetrazol-1-yl)phenyl]acetamide?
The canonical SMILES for N-[(6S)-5,6,7,8-tetrahydroimidazo[1,2-a]pyridin-6-yl]-2-[4-(tetrazol-1-yl)phenyl]acetamide is O=C(Cc1ccc(-n2cnnn2)cc1)N[C@H]1CCc2nccn2C1.
What is the InChIKey of N-[(6S)-5,6,7,8-tetrahydroimidazo[1,2-a]pyridin-6-yl]-2-[4-(tetrazol-1-yl)phenyl]acetamide?
The InChIKey is ZPCBVKZWSVXLMK-ZDUSSCGKSA-N. The full InChI is InChI=1S/C16H17N7O/c24-16(19-13-3-6-15-17-7-8-22(15)10-13)9-12-1-4-14(5-2-12)23-11-18-20-21-23/h1-2,4-5,7-8,11,13H,3,6,9-10H2,(H,19,24)/t13-/m0/s1.
What are the key properties of N-[(6S)-5,6,7,8-tetrahydroimidazo[1,2-a]pyridin-6-yl]-2-[4-(tetrazol-1-yl)phenyl]acetamide?
N-[(6S)-5,6,7,8-tetrahydroimidazo[1,2-a]pyridin-6-yl]-2-[4-(tetrazol-1-yl)phenyl]acetamide has a molecular weight of 323.36 g/mol, XLogP of 0.53, 4 rotatable bonds, 1 hydrogen bond donors, and 7 hydrogen bond acceptors.
Where does this data come from?
All data for N-[(6S)-5,6,7,8-tetrahydroimidazo[1,2-a]pyridin-6-yl]-2-[4-(tetrazol-1-yl)phenyl]acetamide is sourced from PubChem (CID 95139320), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).