N-[(6S)-5,6,7,8-tetrahydroimidazo[1,2-a]pyridin-6-yl]-3-(1,2,4-triazol-1-yl)propanamide

C12H16N6O — CID 97084868

IUPACN-[(6S)-5,6,7,8-tetrahydroimidazo[1,2-a]pyridin-6-yl]-3-(1,2,4-triazol-1-yl)propanamide
SMILESO=C(CCn1cncn1)N[C@H]1CCc2nccn2C1
InChIInChI=1S/C12H16N6O/c19-12(3-5-18-9-13-8-15-18)16-10-1-2-11-14-4-6-17(11)7-10/h4,6,8-10H,1-3,5,7H2,(H,16,19)/t10-/m0/s1
InChIKeyLICPAUISWFJOKQ-JTQLQIEISA-N
MW260.30 g/mol
LogP-0.00
Rot. Bonds4

About N-[(6S)-5,6,7,8-tetrahydroimidazo[1,2-a]pyridin-6-yl]-3-(1,2,4-triazol-1-yl)propanamide

N-[(6S)-5,6,7,8-tetrahydroimidazo[1,2-a]pyridin-6-yl]-3-(1,2,4-triazol-1-yl)propanamide (PubChem CID 97084868) has the molecular formula C12H16N6O and a molecular weight of 260.30 g/mol. Its IUPAC name is N-[(6S)-5,6,7,8-tetrahydroimidazo[1,2-a]pyridin-6-yl]-3-(1,2,4-triazol-1-yl)propanamide.

Molecular Properties

Compound NameN-[(6S)-5,6,7,8-tetrahydroimidazo[1,2-a]pyridin-6-yl]-3-(1,2,4-triazol-1-yl)propanamide
PubChem CID97084868
Molecular FormulaC12H16N6O
Molecular Weight260.30 g/mol
Exact Mass260.14
IUPAC NameN-[(6S)-5,6,7,8-tetrahydroimidazo[1,2-a]pyridin-6-yl]-3-(1,2,4-triazol-1-yl)propanamide
SMILESO=C(CCn1cncn1)N[C@H]1CCc2nccn2C1
InChIInChI=1S/C12H16N6O/c19-12(3-5-18-9-13-8-15-18)16-10-1-2-11-14-4-6-17(11)7-10/h4,6,8-10H,1-3,5,7H2,(H,16,19)/t10-/m0/s1
InChIKeyLICPAUISWFJOKQ-JTQLQIEISA-N
XLogP-0.00
TPSA77.63 Ų
H-Bond Donors1
H-Bond Acceptors6
Rotatable Bonds4
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500260.30
LogP ≤ 5-0.00
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 106

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Related Compounds

N-cyclooctyl-3-(1,2,4-triazol-1-yl)propanamide
CID 31336018
N-[(6R)-5,6,7,8-tetrahydroimidazo[1,2-a]pyridin-6-yl]-3-(1,3,5-trimethylpyrazol-4-yl)propanamide
CID 95279118
2-methoxy-N-(5,6,7,8-tetrahydroimidazo[1,2-a]pyridin-6-yl)acetamide
CID 86771999
4-pyridin-2-yl-N-[(6R)-5,6,7,8-tetrahydroimidazo[1,2-a]pyridin-6-yl]butanamide
CID 95762622
N-[(3S)-1-(2-phenylethyl)piperidin-3-yl]-3-(1,2,4-triazol-1-yl)propanamide
CID 25378372
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-[(2R)-oxolan-2-yl]-N-[(6R)-5,6,7,8-tetrahydroimidazo[1,2-a]pyridin-6-yl]acetamide
CID 95765472
2-(2,3-dihydro-1H-inden-5-yl)-N-[(6R)-5,6,7,8-tetrahydroimidazo[1,2-a]pyridin-6-yl]acetamide
CID 95765541
4-(2-methylphenoxy)-N-(5,6,7,8-tetrahydroimidazo[1,2-a]pyridin-6-yl)butanamide
CID 86772130
2-(3-methyl-6-oxopyridazin-1-yl)-N-[(6S)-5,6,7,8-tetrahydroimidazo[1,2-a]pyridin-6-yl]acetamide
CID 95761041
N-[(1S,3S)-3-[(4-pyridin-3-ylpyrimidin-2-yl)amino]cyclopentyl]-3-(1,2,4-triazol-1-yl)propanamide
CID 56883043
N-[(3R)-1-pyrazin-2-ylpiperidin-3-yl]-4-(1,2,4-triazol-1-yl)butanamide
CID 99981987

Frequently Asked Questions

What is the IUPAC name of N-[(6S)-5,6,7,8-tetrahydroimidazo[1,2-a]pyridin-6-yl]-3-(1,2,4-triazol-1-yl)propanamide?
The IUPAC name of N-[(6S)-5,6,7,8-tetrahydroimidazo[1,2-a]pyridin-6-yl]-3-(1,2,4-triazol-1-yl)propanamide (CID 97084868) is N-[(6S)-5,6,7,8-tetrahydroimidazo[1,2-a]pyridin-6-yl]-3-(1,2,4-triazol-1-yl)propanamide.
What is the SMILES notation for N-[(6S)-5,6,7,8-tetrahydroimidazo[1,2-a]pyridin-6-yl]-3-(1,2,4-triazol-1-yl)propanamide?
The canonical SMILES for N-[(6S)-5,6,7,8-tetrahydroimidazo[1,2-a]pyridin-6-yl]-3-(1,2,4-triazol-1-yl)propanamide is O=C(CCn1cncn1)N[C@H]1CCc2nccn2C1.
What is the InChIKey of N-[(6S)-5,6,7,8-tetrahydroimidazo[1,2-a]pyridin-6-yl]-3-(1,2,4-triazol-1-yl)propanamide?
The InChIKey is LICPAUISWFJOKQ-JTQLQIEISA-N. The full InChI is InChI=1S/C12H16N6O/c19-12(3-5-18-9-13-8-15-18)16-10-1-2-11-14-4-6-17(11)7-10/h4,6,8-10H,1-3,5,7H2,(H,16,19)/t10-/m0/s1.
What are the key properties of N-[(6S)-5,6,7,8-tetrahydroimidazo[1,2-a]pyridin-6-yl]-3-(1,2,4-triazol-1-yl)propanamide?
N-[(6S)-5,6,7,8-tetrahydroimidazo[1,2-a]pyridin-6-yl]-3-(1,2,4-triazol-1-yl)propanamide has a molecular weight of 260.30 g/mol, XLogP of -0.00, 4 rotatable bonds, 1 hydrogen bond donors, and 6 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]-3-(1,2,4-triazol-1-yl)propanamide is sourced from PubChem (CID 97084868), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).