[1-(aminomethyl)-4-methylcyclohexyl]-(6,8-dihydro-5H-imidazo[1,2-a]pyrazin-7-yl)methanone

C15H24N4O — CID 115442125

IUPAC[1-(aminomethyl)-4-methylcyclohexyl]-(6,8-dihydro-5H-imidazo[1,2-a]pyrazin-7-yl)methanone
SMILESCC1CCC(CN)(C(=O)N2CCn3ccnc3C2)CC1
InChIInChI=1S/C15H24N4O/c1-12-2-4-15(11-16,5-3-12)14(20)19-9-8-18-7-6-17-13(18)10-19/h6-7,12H,2-5,8-11,16H2,1H3
InChIKeyAYLUJPFOGFQVMD-UHFFFAOYSA-N
MW276.38 g/mol
LogP1.38
Rot. Bonds2

About [1-(aminomethyl)-4-methylcyclohexyl]-(6,8-dihydro-5H-imidazo[1,2-a]pyrazin-7-yl)methanone

[1-(aminomethyl)-4-methylcyclohexyl]-(6,8-dihydro-5H-imidazo[1,2-a]pyrazin-7-yl)methanone (PubChem CID 115442125) has the molecular formula C15H24N4O and a molecular weight of 276.38 g/mol. Its IUPAC name is [1-(aminomethyl)-4-methylcyclohexyl]-(6,8-dihydro-5H-imidazo[1,2-a]pyrazin-7-yl)methanone.

Molecular Properties

Compound Name[1-(aminomethyl)-4-methylcyclohexyl]-(6,8-dihydro-5H-imidazo[1,2-a]pyrazin-7-yl)methanone
PubChem CID115442125
Molecular FormulaC15H24N4O
Molecular Weight276.38 g/mol
Exact Mass276.20
IUPAC Name[1-(aminomethyl)-4-methylcyclohexyl]-(6,8-dihydro-5H-imidazo[1,2-a]pyrazin-7-yl)methanone
SMILESCC1CCC(CN)(C(=O)N2CCn3ccnc3C2)CC1
InChIInChI=1S/C15H24N4O/c1-12-2-4-15(11-16,5-3-12)14(20)19-9-8-18-7-6-17-13(18)10-19/h6-7,12H,2-5,8-11,16H2,1H3
InChIKeyAYLUJPFOGFQVMD-UHFFFAOYSA-N
XLogP1.38
TPSA64.15 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds2
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500276.38
LogP ≤ 51.38
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Related Compounds

cyclohexyl-N-(3-imidazolylpropyl)carboxamide
CID 3425823
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CID 70777392
2-(Cyclopropylmethyl)-9-[3-(2-methylimidazol-1-yl)propanoyl]-2,9-diazaspiro[5.5]undecan-3-one
CID 72890498
(3r,5r,7r)-N-(2-(2-methyl-1H-imidazol-1-yl)ethyl)adamantane-1-carboxamide
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(4R,8R)-1-methyl-8-[(1-methylimidazol-2-yl)methylamino]-4-(4-methylpiperazine-1-carbonyl)azonan-2-one
CID 75411796
N-[2-(1H-imidazol-1-yl)ethyl]-3-(1-methyl-3-piperidinyl)propanamide
CID 72891266
(5S)-7-(cyclohexylmethyl)-2-[(1-ethylimidazol-2-yl)methyl]-2,7-diazaspiro[4.5]decan-6-one
CID 92404938
cyclohexyl-[(3S)-3-(1-ethylimidazol-2-yl)piperidin-1-yl]methanone
CID 97155574
N-(5,6,7,8-tetrahydroimidazo[1,2-a]pyridin-6-yl)-3-(trifluoromethyl)cyclohexane-1-carboxamide
CID 53544295
cis-(1R,3S)-N-[(6R)-5,6,7,8-tetrahydroimidazo[1,2-a]pyridin-6-yl]-3-(trifluoromethyl)cyclohexane-1-carboxamide
CID 95149733
trans-(1S,3S)-N-[(6R)-5,6,7,8-tetrahydroimidazo[1,2-a]pyridin-6-yl]-3-(trifluoromethyl)cyclohexane-1-carboxamide
CID 95149735
trans-(1R,3R)-N-[(6R)-5,6,7,8-tetrahydroimidazo[1,2-a]pyridin-6-yl]-3-(trifluoromethyl)cyclohexane-1-carboxamide
CID 100085639

Frequently Asked Questions

What is the IUPAC name of [1-(aminomethyl)-4-methylcyclohexyl]-(6,8-dihydro-5H-imidazo[1,2-a]pyrazin-7-yl)methanone?
The IUPAC name of [1-(aminomethyl)-4-methylcyclohexyl]-(6,8-dihydro-5H-imidazo[1,2-a]pyrazin-7-yl)methanone (CID 115442125) is [1-(aminomethyl)-4-methylcyclohexyl]-(6,8-dihydro-5H-imidazo[1,2-a]pyrazin-7-yl)methanone.
What is the SMILES notation for [1-(aminomethyl)-4-methylcyclohexyl]-(6,8-dihydro-5H-imidazo[1,2-a]pyrazin-7-yl)methanone?
The canonical SMILES for [1-(aminomethyl)-4-methylcyclohexyl]-(6,8-dihydro-5H-imidazo[1,2-a]pyrazin-7-yl)methanone is CC1CCC(CN)(C(=O)N2CCn3ccnc3C2)CC1.
What is the InChIKey of [1-(aminomethyl)-4-methylcyclohexyl]-(6,8-dihydro-5H-imidazo[1,2-a]pyrazin-7-yl)methanone?
The InChIKey is AYLUJPFOGFQVMD-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H24N4O/c1-12-2-4-15(11-16,5-3-12)14(20)19-9-8-18-7-6-17-13(18)10-19/h6-7,12H,2-5,8-11,16H2,1H3.
What are the key properties of [1-(aminomethyl)-4-methylcyclohexyl]-(6,8-dihydro-5H-imidazo[1,2-a]pyrazin-7-yl)methanone?
[1-(aminomethyl)-4-methylcyclohexyl]-(6,8-dihydro-5H-imidazo[1,2-a]pyrazin-7-yl)methanone has a molecular weight of 276.38 g/mol, XLogP of 1.38, 2 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for [1-(aminomethyl)-4-methylcyclohexyl]-(6,8-dihydro-5H-imidazo[1,2-a]pyrazin-7-yl)methanone is sourced from PubChem (CID 115442125), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).