N,N-dimethyl-4-[(2-methylcyclopentyl)amino]butanamide

C12H24N2O — CID 63278012

IUPACN,N-dimethyl-4-[(2-methylcyclopentyl)amino]butanamide
SMILESCC1CCCC1NCCCC(=O)N(C)C
InChIInChI=1S/C12H24N2O/c1-10-6-4-7-11(10)13-9-5-8-12(15)14(2)3/h10-11,13H,4-9H2,1-3H3
InChIKeyUESVTQPBIGRHSJ-UHFFFAOYSA-N
MW212.34 g/mol
LogP1.63
Rot. Bonds5

About N,N-dimethyl-4-[(2-methylcyclopentyl)amino]butanamide

N,N-dimethyl-4-[(2-methylcyclopentyl)amino]butanamide (PubChem CID 63278012) has the molecular formula C12H24N2O and a molecular weight of 212.34 g/mol. Its IUPAC name is N,N-dimethyl-4-[(2-methylcyclopentyl)amino]butanamide.

Molecular Properties

Compound NameN,N-dimethyl-4-[(2-methylcyclopentyl)amino]butanamide
PubChem CID63278012
Molecular FormulaC12H24N2O
Molecular Weight212.34 g/mol
Exact Mass212.19
IUPAC NameN,N-dimethyl-4-[(2-methylcyclopentyl)amino]butanamide
SMILESCC1CCCC1NCCCC(=O)N(C)C
InChIInChI=1S/C12H24N2O/c1-10-6-4-7-11(10)13-9-5-8-12(15)14(2)3/h10-11,13H,4-9H2,1-3H3
InChIKeyUESVTQPBIGRHSJ-UHFFFAOYSA-N
XLogP1.63
TPSA32.34 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds5
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500212.34
LogP ≤ 51.63
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'Aliphatic_long_chain', 'substructure': 'N/A'}

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Frequently Asked Questions

What is the IUPAC name of N,N-dimethyl-4-[(2-methylcyclopentyl)amino]butanamide?
The IUPAC name of N,N-dimethyl-4-[(2-methylcyclopentyl)amino]butanamide (CID 63278012) is N,N-dimethyl-4-[(2-methylcyclopentyl)amino]butanamide.
What is the SMILES notation for N,N-dimethyl-4-[(2-methylcyclopentyl)amino]butanamide?
The canonical SMILES for N,N-dimethyl-4-[(2-methylcyclopentyl)amino]butanamide is CC1CCCC1NCCCC(=O)N(C)C.
What is the InChIKey of N,N-dimethyl-4-[(2-methylcyclopentyl)amino]butanamide?
The InChIKey is UESVTQPBIGRHSJ-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H24N2O/c1-10-6-4-7-11(10)13-9-5-8-12(15)14(2)3/h10-11,13H,4-9H2,1-3H3.
What are the key properties of N,N-dimethyl-4-[(2-methylcyclopentyl)amino]butanamide?
N,N-dimethyl-4-[(2-methylcyclopentyl)amino]butanamide has a molecular weight of 212.34 g/mol, XLogP of 1.63, 5 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N,N-dimethyl-4-[(2-methylcyclopentyl)amino]butanamide is sourced from PubChem (CID 63278012), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).