1-[1-(cyclobutylmethyl)piperidin-4-yl]-N,N-dimethylpiperidine-4-carboxamide

C18H33N3O — CID 97406505

IUPAC1-[1-(cyclobutylmethyl)piperidin-4-yl]-N,N-dimethylpiperidine-4-carboxamide
SMILESCN(C)C(=O)C1CCN(C2CCN(CC3CCC3)CC2)CC1
InChIInChI=1S/C18H33N3O/c1-19(2)18(22)16-6-12-21(13-7-16)17-8-10-20(11-9-17)14-15-4-3-5-15/h15-17H,3-14H2,1-2H3
InChIKeyIKIZWYRKKJUNIM-UHFFFAOYSA-N
MW307.48 g/mol
LogP2.05
Rot. Bonds4

About 1-[1-(cyclobutylmethyl)piperidin-4-yl]-N,N-dimethylpiperidine-4-carboxamide

1-[1-(cyclobutylmethyl)piperidin-4-yl]-N,N-dimethylpiperidine-4-carboxamide (PubChem CID 97406505) has the molecular formula C18H33N3O and a molecular weight of 307.48 g/mol. Its IUPAC name is 1-[1-(cyclobutylmethyl)piperidin-4-yl]-N,N-dimethylpiperidine-4-carboxamide.

Molecular Properties

Compound Name1-[1-(cyclobutylmethyl)piperidin-4-yl]-N,N-dimethylpiperidine-4-carboxamide
PubChem CID97406505
Molecular FormulaC18H33N3O
Molecular Weight307.48 g/mol
Exact Mass307.26
IUPAC Name1-[1-(cyclobutylmethyl)piperidin-4-yl]-N,N-dimethylpiperidine-4-carboxamide
SMILESCN(C)C(=O)C1CCN(C2CCN(CC3CCC3)CC2)CC1
InChIInChI=1S/C18H33N3O/c1-19(2)18(22)16-6-12-21(13-7-16)17-8-10-20(11-9-17)14-15-4-3-5-15/h15-17H,3-14H2,1-2H3
InChIKeyIKIZWYRKKJUNIM-UHFFFAOYSA-N
XLogP2.05
TPSA26.79 Ų
H-Bond Donors
H-Bond Acceptors3
Rotatable Bonds4
Heavy Atoms22
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500307.48
LogP ≤ 52.05
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 103

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Related Compounds

N,N-dimethyl-1-(1-methylpiperidin-4-yl)piperidine-4-carboxamide
CID 97520888
N,N-dimethyl-1-(1-propan-2-ylpiperidin-4-yl)piperidine-4-carboxamide
CID 97406503
1-[1-(cyclopropylmethyl)piperidin-4-yl]-N,N-dimethylpiperidine-4-carboxamide
CID 97406504
1-(1-ethylpiperidin-4-yl)-N,N-dimethylpiperidine-4-carboxamide
CID 97520889
N,N-dimethyl-1-[1-(2-methylpropyl)piperidin-4-yl]piperidine-4-carboxamide
CID 97520890
1-[4-(Piperidine-1-carbonyl)-[1,4'-bipiperidin]-1'-YL]pentan-1-one
CID 42693384
1'-Propyl-1,4'-bipiperidine-4-carboxamide
CID 30982891
N-[(3S)-1-(2-ethylbutanoyl)piperidin-3-yl]-N-(2-piperidin-1-ylethyl)acetamide
CID 164636914
(1-Tert-butylpiperidin-4-yl)-[4-[methyl(2,2,2-trifluoroethyl)amino]piperidin-1-yl]methanone
CID 118531418
(3,3-Difluoropiperidin-1-yl)-(1-propan-2-ylpiperidin-4-yl)methanone;2-methylpropane
CID 177247608
Sdccgsbi-0117564.P001
CID 25375391
N-ethyl-4,4,4-trifluoro-N-[(1'-methyl-1,4'-bipiperidin-4-yl)methyl]butanamide
CID 28954216

Frequently Asked Questions

What is the IUPAC name of 1-[1-(cyclobutylmethyl)piperidin-4-yl]-N,N-dimethylpiperidine-4-carboxamide?
The IUPAC name of 1-[1-(cyclobutylmethyl)piperidin-4-yl]-N,N-dimethylpiperidine-4-carboxamide (CID 97406505) is 1-[1-(cyclobutylmethyl)piperidin-4-yl]-N,N-dimethylpiperidine-4-carboxamide.
What is the SMILES notation for 1-[1-(cyclobutylmethyl)piperidin-4-yl]-N,N-dimethylpiperidine-4-carboxamide?
The canonical SMILES for 1-[1-(cyclobutylmethyl)piperidin-4-yl]-N,N-dimethylpiperidine-4-carboxamide is CN(C)C(=O)C1CCN(C2CCN(CC3CCC3)CC2)CC1.
What is the InChIKey of 1-[1-(cyclobutylmethyl)piperidin-4-yl]-N,N-dimethylpiperidine-4-carboxamide?
The InChIKey is IKIZWYRKKJUNIM-UHFFFAOYSA-N. The full InChI is InChI=1S/C18H33N3O/c1-19(2)18(22)16-6-12-21(13-7-16)17-8-10-20(11-9-17)14-15-4-3-5-15/h15-17H,3-14H2,1-2H3.
What are the key properties of 1-[1-(cyclobutylmethyl)piperidin-4-yl]-N,N-dimethylpiperidine-4-carboxamide?
1-[1-(cyclobutylmethyl)piperidin-4-yl]-N,N-dimethylpiperidine-4-carboxamide has a molecular weight of 307.48 g/mol, XLogP of 2.05, 4 rotatable bonds, 0 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 1-[1-(cyclobutylmethyl)piperidin-4-yl]-N,N-dimethylpiperidine-4-carboxamide is sourced from PubChem (CID 97406505), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).