2-(cyclopentylamino)-N',N'-dimethylbutanediamide

C11H21N3O2 — CID 66430853

IUPAC2-(cyclopentylamino)-N',N'-dimethylbutanediamide
SMILESCN(C)C(=O)CC(NC1CCCC1)C(N)=O
InChIInChI=1S/C11H21N3O2/c1-14(2)10(15)7-9(11(12)16)13-8-5-3-4-6-8/h8-9,13H,3-7H2,1-2H3,(H2,12,16)
InChIKeyITBCXFRAABVLMQ-UHFFFAOYSA-N
MW227.31 g/mol
LogP-0.15
Rot. Bonds5

About 2-(cyclopentylamino)-N',N'-dimethylbutanediamide

2-(cyclopentylamino)-N',N'-dimethylbutanediamide (PubChem CID 66430853) has the molecular formula C11H21N3O2 and a molecular weight of 227.31 g/mol. Its IUPAC name is 2-(cyclopentylamino)-N',N'-dimethylbutanediamide.

Molecular Properties

Compound Name2-(cyclopentylamino)-N',N'-dimethylbutanediamide
PubChem CID66430853
Molecular FormulaC11H21N3O2
Molecular Weight227.31 g/mol
Exact Mass227.16
IUPAC Name2-(cyclopentylamino)-N',N'-dimethylbutanediamide
SMILESCN(C)C(=O)CC(NC1CCCC1)C(N)=O
InChIInChI=1S/C11H21N3O2/c1-14(2)10(15)7-9(11(12)16)13-8-5-3-4-6-8/h8-9,13H,3-7H2,1-2H3,(H2,12,16)
InChIKeyITBCXFRAABVLMQ-UHFFFAOYSA-N
XLogP-0.15
TPSA75.43 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds5
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500227.31
LogP ≤ 5-0.15
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Related Compounds

2-(cyclopentylamino)-3-methoxypropanamide
CID 115924491
2-(butan-2-ylamino)-N',N'-dimethylbutanediamide
CID 66431267
(4S)-5-amino-4-(cyclopentylamino)-5-oxopentanoic acid
CID 67333173
(4S)-5-amino-4-(cyclooctylamino)-5-oxopentanoic acid
CID 67336025
2-(cyclohexylamino)octanamide
CID 54893908
2-(cyclopropylamino)-4-[methyl-(2-methylcyclohexyl)amino]butanamide
CID 63053076
(2S)-2-(cycloheptylamino)propanamide
CID 93300220
2-(cyclopropylamino)-5-(methylamino)hexanediamide
CID 66221949
4-O-tert-butyl 1-O-methyl 2-(cyclopentylamino)butanedioate
CID 66586456
4-O-tert-butyl 1-O-methyl (2R)-2-(cyclopentylamino)butanedioate
CID 66586454
2-(cyclododecylamino)-N,N-dimethylacetamide
CID 43214559
2-(cyclopentylamino)butanoic acid
CID 60998249

Frequently Asked Questions

What is the IUPAC name of 2-(cyclopentylamino)-N',N'-dimethylbutanediamide?
The IUPAC name of 2-(cyclopentylamino)-N',N'-dimethylbutanediamide (CID 66430853) is 2-(cyclopentylamino)-N',N'-dimethylbutanediamide.
What is the SMILES notation for 2-(cyclopentylamino)-N',N'-dimethylbutanediamide?
The canonical SMILES for 2-(cyclopentylamino)-N',N'-dimethylbutanediamide is CN(C)C(=O)CC(NC1CCCC1)C(N)=O.
What is the InChIKey of 2-(cyclopentylamino)-N',N'-dimethylbutanediamide?
The InChIKey is ITBCXFRAABVLMQ-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H21N3O2/c1-14(2)10(15)7-9(11(12)16)13-8-5-3-4-6-8/h8-9,13H,3-7H2,1-2H3,(H2,12,16).
What are the key properties of 2-(cyclopentylamino)-N',N'-dimethylbutanediamide?
2-(cyclopentylamino)-N',N'-dimethylbutanediamide has a molecular weight of 227.31 g/mol, XLogP of -0.15, 5 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(cyclopentylamino)-N',N'-dimethylbutanediamide is sourced from PubChem (CID 66430853), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).