1-(cyclopropylamino)-3-[4-(dimethylamino)piperidin-1-yl]cyclopentane-1-carboxamide

C16H30N4O — CID 79645865

IUPAC1-(cyclopropylamino)-3-[4-(dimethylamino)piperidin-1-yl]cyclopentane-1-carboxamide
SMILESCN(C)C1CCN(C2CCC(NC3CC3)(C(N)=O)C2)CC1
InChIInChI=1S/C16H30N4O/c1-19(2)13-6-9-20(10-7-13)14-5-8-16(11-14,15(17)21)18-12-3-4-12/h12-14,18H,3-11H2,1-2H3,(H2,17,21)
InChIKeyHEDLLTAOCPMCOW-UHFFFAOYSA-N
MW294.44 g/mol
LogP0.54
Rot. Bonds5

About 1-(cyclopropylamino)-3-[4-(dimethylamino)piperidin-1-yl]cyclopentane-1-carboxamide

1-(cyclopropylamino)-3-[4-(dimethylamino)piperidin-1-yl]cyclopentane-1-carboxamide (PubChem CID 79645865) has the molecular formula C16H30N4O and a molecular weight of 294.44 g/mol. Its IUPAC name is 1-(cyclopropylamino)-3-[4-(dimethylamino)piperidin-1-yl]cyclopentane-1-carboxamide.

Molecular Properties

Compound Name1-(cyclopropylamino)-3-[4-(dimethylamino)piperidin-1-yl]cyclopentane-1-carboxamide
PubChem CID79645865
Molecular FormulaC16H30N4O
Molecular Weight294.44 g/mol
Exact Mass294.24
IUPAC Name1-(cyclopropylamino)-3-[4-(dimethylamino)piperidin-1-yl]cyclopentane-1-carboxamide
SMILESCN(C)C1CCN(C2CCC(NC3CC3)(C(N)=O)C2)CC1
InChIInChI=1S/C16H30N4O/c1-19(2)13-6-9-20(10-7-13)14-5-8-16(11-14,15(17)21)18-12-3-4-12/h12-14,18H,3-11H2,1-2H3,(H2,17,21)
InChIKeyHEDLLTAOCPMCOW-UHFFFAOYSA-N
XLogP0.54
TPSA61.60 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds5
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500294.44
LogP ≤ 50.54
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

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Related Compounds

1-(cyclopropylamino)-3-[3-(dimethylamino)piperidin-1-yl]cyclopentane-1-carboxamide
CID 79645673
1-(cyclopropylamino)-3-(4-propylpiperidin-1-yl)cyclopentane-1-carboxamide
CID 79647898
3-[4-(dimethylamino)piperidin-1-yl]-1-(methylamino)cyclohexane-1-carboxamide
CID 79636383
1-(cyclopropylamino)-3-piperidin-1-ylcyclohexane-1-carboxamide
CID 79636357
1-(cyclopropylamino)-3-(2-ethylmorpholin-4-yl)cyclopentane-1-carboxamide
CID 79655045
1-(cyclopropylamino)-3-methylcyclopentane-1-carboxamide
CID 64513100
3-(4-cyclopropylpiperazin-1-yl)-1-(methylamino)cyclopentane-1-carboxamide
CID 79651474
methyl 1-(cyclopropylamino)-3-(4-methoxypiperidin-1-yl)cyclopentane-1-carboxylate
CID 79645623
ethyl 1-(cyclopropylamino)-3-(4-methylpiperidin-1-yl)cyclopentane-1-carboxylate
CID 79645147
1-(cyclopropylamino)-3-piperidin-1-ylcyclopentane-1-carboxylic acid
CID 79649865
3-[3-(dimethylamino)pyrrolidin-1-yl]-1-(propylamino)cyclohexane-1-carboxamide
CID 79628730
1-(cyclopropylamino)-3-[4-(trifluoromethyl)pyrazol-1-yl]cyclopentane-1-carboxamide
CID 79646419

Frequently Asked Questions

What is the IUPAC name of 1-(cyclopropylamino)-3-[4-(dimethylamino)piperidin-1-yl]cyclopentane-1-carboxamide?
The IUPAC name of 1-(cyclopropylamino)-3-[4-(dimethylamino)piperidin-1-yl]cyclopentane-1-carboxamide (CID 79645865) is 1-(cyclopropylamino)-3-[4-(dimethylamino)piperidin-1-yl]cyclopentane-1-carboxamide.
What is the SMILES notation for 1-(cyclopropylamino)-3-[4-(dimethylamino)piperidin-1-yl]cyclopentane-1-carboxamide?
The canonical SMILES for 1-(cyclopropylamino)-3-[4-(dimethylamino)piperidin-1-yl]cyclopentane-1-carboxamide is CN(C)C1CCN(C2CCC(NC3CC3)(C(N)=O)C2)CC1.
What is the InChIKey of 1-(cyclopropylamino)-3-[4-(dimethylamino)piperidin-1-yl]cyclopentane-1-carboxamide?
The InChIKey is HEDLLTAOCPMCOW-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H30N4O/c1-19(2)13-6-9-20(10-7-13)14-5-8-16(11-14,15(17)21)18-12-3-4-12/h12-14,18H,3-11H2,1-2H3,(H2,17,21).
What are the key properties of 1-(cyclopropylamino)-3-[4-(dimethylamino)piperidin-1-yl]cyclopentane-1-carboxamide?
1-(cyclopropylamino)-3-[4-(dimethylamino)piperidin-1-yl]cyclopentane-1-carboxamide has a molecular weight of 294.44 g/mol, XLogP of 0.54, 5 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 1-(cyclopropylamino)-3-[4-(dimethylamino)piperidin-1-yl]cyclopentane-1-carboxamide is sourced from PubChem (CID 79645865), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).