[4-[1-(cyclopropylmethyl)imidazol-2-yl]piperidin-1-yl]-[1-(methoxymethyl)cyclobutyl]methanone

C19H29N3O2 — CID 70744783

IUPAC[4-[1-(cyclopropylmethyl)imidazol-2-yl]piperidin-1-yl]-[1-(methoxymethyl)cyclobutyl]methanone
SMILESCOCC1(C(=O)N2CCC(c3nccn3CC3CC3)CC2)CCC1
InChIInChI=1S/C19H29N3O2/c1-24-14-19(7-2-8-19)18(23)21-10-5-16(6-11-21)17-20-9-12-22(17)13-15-3-4-15/h9,12,15-16H,2-8,10-11,13-14H2,1H3
InChIKeyRMVGZKLUSKCWQH-UHFFFAOYSA-N
MW331.46 g/mol
LogP2.82
Rot. Bonds6

About [4-[1-(cyclopropylmethyl)imidazol-2-yl]piperidin-1-yl]-[1-(methoxymethyl)cyclobutyl]methanone

[4-[1-(cyclopropylmethyl)imidazol-2-yl]piperidin-1-yl]-[1-(methoxymethyl)cyclobutyl]methanone (PubChem CID 70744783) has the molecular formula C19H29N3O2 and a molecular weight of 331.46 g/mol. Its IUPAC name is [4-[1-(cyclopropylmethyl)imidazol-2-yl]piperidin-1-yl]-[1-(methoxymethyl)cyclobutyl]methanone.

Molecular Properties

Compound Name[4-[1-(cyclopropylmethyl)imidazol-2-yl]piperidin-1-yl]-[1-(methoxymethyl)cyclobutyl]methanone
PubChem CID70744783
Molecular FormulaC19H29N3O2
Molecular Weight331.46 g/mol
Exact Mass331.23
IUPAC Name[4-[1-(cyclopropylmethyl)imidazol-2-yl]piperidin-1-yl]-[1-(methoxymethyl)cyclobutyl]methanone
SMILESCOCC1(C(=O)N2CCC(c3nccn3CC3CC3)CC2)CCC1
InChIInChI=1S/C19H29N3O2/c1-24-14-19(7-2-8-19)18(23)21-10-5-16(6-11-21)17-20-9-12-22(17)13-15-3-4-15/h9,12,15-16H,2-8,10-11,13-14H2,1H3
InChIKeyRMVGZKLUSKCWQH-UHFFFAOYSA-N
XLogP2.82
TPSA47.36 Ų
H-Bond Donors
H-Bond Acceptors4
Rotatable Bonds6
Heavy Atoms24
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500331.46
LogP ≤ 52.82
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 104

Analyze [4-[1-(cyclopropylmethyl)imidazol-2-yl]piperidin-1-yl]-[1-(methoxymethyl)cyclobutyl]methanone with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Related Compounds

1-(cyclobutylcarbonyl)-N-methyl-N-[2-(2-methyl-1H-imidazol-1-yl)ethyl]-4-piperidinecarboxamide
CID 72857947
1-(cyclopropylcarbonyl)-N-methyl-N-[3-(1-methyl-1H-imidazol-2-yl)propyl]-4-piperidinecarboxamide
CID 72893576
1-(cyclobutylcarbonyl)-N-methyl-N-[3-(1-methyl-1H-imidazol-2-yl)propyl]-4-piperidinecarboxamide
CID 72924602
1-[4-[(2-Ethylimidazol-1-yl)methyl]piperidin-1-yl]-2,2-dimethylpropan-1-one
CID 56724024
N-[2-(1H-imidazol-1-yl)ethyl]-1-(methoxymethyl)cyclobutanecarboxamide
CID 50970012
[4-(1-Methylimidazol-2-yl)piperazin-1-yl]-(oxan-3-yl)methanone
CID 71990992
7-[2-(2-ethyl-1H-imidazol-1-yl)ethyl]-2-oxa-7-azaspiro[4.5]decan-8-one
CID 72862931
4-(1-ethyl-1H-imidazol-2-yl)-1-(3-methoxypropanoyl)piperidine
CID 72911298
[4-[1-(cyclopropylmethyl)imidazol-2-yl]piperidin-1-yl]-[(3S)-oxolan-3-yl]methanone
CID 97187110
2,2-Difluoro-2-(1-hydroxycyclobutyl)-1-[3-[(1-methylimidazol-2-yl)methyl]piperidin-1-yl]ethanone
CID 109903188
[4-[[1-(Difluoromethyl)imidazol-2-yl]methyl]piperazin-1-yl]-(3,3-dimethylcyclobutyl)methanone
CID 126803909
[2-[1-(Cyclopropylmethyl)imidazol-2-yl]-3,3-dimethylazetidin-1-yl]-[4-(fluoromethyl)oxan-4-yl]methanone
CID 132403752

Frequently Asked Questions

What is the IUPAC name of [4-[1-(cyclopropylmethyl)imidazol-2-yl]piperidin-1-yl]-[1-(methoxymethyl)cyclobutyl]methanone?
The IUPAC name of [4-[1-(cyclopropylmethyl)imidazol-2-yl]piperidin-1-yl]-[1-(methoxymethyl)cyclobutyl]methanone (CID 70744783) is [4-[1-(cyclopropylmethyl)imidazol-2-yl]piperidin-1-yl]-[1-(methoxymethyl)cyclobutyl]methanone.
What is the SMILES notation for [4-[1-(cyclopropylmethyl)imidazol-2-yl]piperidin-1-yl]-[1-(methoxymethyl)cyclobutyl]methanone?
The canonical SMILES for [4-[1-(cyclopropylmethyl)imidazol-2-yl]piperidin-1-yl]-[1-(methoxymethyl)cyclobutyl]methanone is COCC1(C(=O)N2CCC(c3nccn3CC3CC3)CC2)CCC1.
What is the InChIKey of [4-[1-(cyclopropylmethyl)imidazol-2-yl]piperidin-1-yl]-[1-(methoxymethyl)cyclobutyl]methanone?
The InChIKey is RMVGZKLUSKCWQH-UHFFFAOYSA-N. The full InChI is InChI=1S/C19H29N3O2/c1-24-14-19(7-2-8-19)18(23)21-10-5-16(6-11-21)17-20-9-12-22(17)13-15-3-4-15/h9,12,15-16H,2-8,10-11,13-14H2,1H3.
What are the key properties of [4-[1-(cyclopropylmethyl)imidazol-2-yl]piperidin-1-yl]-[1-(methoxymethyl)cyclobutyl]methanone?
[4-[1-(cyclopropylmethyl)imidazol-2-yl]piperidin-1-yl]-[1-(methoxymethyl)cyclobutyl]methanone has a molecular weight of 331.46 g/mol, XLogP of 2.82, 6 rotatable bonds, 0 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for [4-[1-(cyclopropylmethyl)imidazol-2-yl]piperidin-1-yl]-[1-(methoxymethyl)cyclobutyl]methanone is sourced from PubChem (CID 70744783), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).