2-amino-N-[4-(dimethylamino)phenyl]cyclopentane-1-carboxamide

C14H21N3O — CID 64823318

IUPAC2-amino-N-[4-(dimethylamino)phenyl]cyclopentane-1-carboxamide
SMILESCN(C)c1ccc(NC(=O)C2CCCC2N)cc1
InChIInChI=1S/C14H21N3O/c1-17(2)11-8-6-10(7-9-11)16-14(18)12-4-3-5-13(12)15/h6-9,12-13H,3-5,15H2,1-2H3,(H,16,18)
InChIKeyMONRKJQBDKSVSN-UHFFFAOYSA-N
MW247.34 g/mol
LogP1.82
Rot. Bonds3

About 2-amino-N-[4-(dimethylamino)phenyl]cyclopentane-1-carboxamide

2-amino-N-[4-(dimethylamino)phenyl]cyclopentane-1-carboxamide (PubChem CID 64823318) has the molecular formula C14H21N3O and a molecular weight of 247.34 g/mol. Its IUPAC name is 2-amino-N-[4-(dimethylamino)phenyl]cyclopentane-1-carboxamide.

Molecular Properties

Compound Name2-amino-N-[4-(dimethylamino)phenyl]cyclopentane-1-carboxamide
PubChem CID64823318
Molecular FormulaC14H21N3O
Molecular Weight247.34 g/mol
Exact Mass247.17
IUPAC Name2-amino-N-[4-(dimethylamino)phenyl]cyclopentane-1-carboxamide
SMILESCN(C)c1ccc(NC(=O)C2CCCC2N)cc1
InChIInChI=1S/C14H21N3O/c1-17(2)11-8-6-10(7-9-11)16-14(18)12-4-3-5-13(12)15/h6-9,12-13H,3-5,15H2,1-2H3,(H,16,18)
InChIKeyMONRKJQBDKSVSN-UHFFFAOYSA-N
XLogP1.82
TPSA58.36 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500247.34
LogP ≤ 51.82
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'anil_di_alk_A(478)', 'substructure': 'N/A'}

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Related Compounds

2-amino-N-[4-(dimethylamino)phenyl]cyclohexane-1-carboxamide
CID 64823317
2-amino-N-[4-(diethylamino)phenyl]cyclohexane-1-carboxamide
CID 64823135
2-amino-N-(4-hydroxyphenyl)cyclopentane-1-carboxamide
CID 64825119
cis-(1S,2R)-2-[[4-(dimethylamino)phenyl]carbamoyl]cyclohexane-1-carboxylic acid
CID 41097683
2-amino-N-(4-methylphenyl)cyclohexane-1-carboxamide
CID 12512511
2-amino-N-[3-(dimethylamino)phenyl]cycloheptane-1-carboxamide
CID 115377162
1-N,2-N-bis[4-(dimethylamino)phenyl]cyclopropane-1,2-dicarboxamide
CID 109143918
2-amino-N-(4-fluorophenyl)cyclopentane-1-carboxamide;hydrochloride
CID 119670661
2-amino-N-(4-bromophenyl)cyclopentane-1-carboxamide;hydrochloride
CID 119670339
methyl 4-[(2-aminocyclopentanecarbonyl)amino]benzoate;hydrochloride
CID 119671361
2-amino-N-(4-bromophenyl)cyclohexane-1-carboxamide
CID 64816780
2-amino-N-[6-(dimethylamino)-3-pyridinyl]cyclohexane-1-carboxamide
CID 64822752

Frequently Asked Questions

What is the IUPAC name of 2-amino-N-[4-(dimethylamino)phenyl]cyclopentane-1-carboxamide?
The IUPAC name of 2-amino-N-[4-(dimethylamino)phenyl]cyclopentane-1-carboxamide (CID 64823318) is 2-amino-N-[4-(dimethylamino)phenyl]cyclopentane-1-carboxamide.
What is the SMILES notation for 2-amino-N-[4-(dimethylamino)phenyl]cyclopentane-1-carboxamide?
The canonical SMILES for 2-amino-N-[4-(dimethylamino)phenyl]cyclopentane-1-carboxamide is CN(C)c1ccc(NC(=O)C2CCCC2N)cc1.
What is the InChIKey of 2-amino-N-[4-(dimethylamino)phenyl]cyclopentane-1-carboxamide?
The InChIKey is MONRKJQBDKSVSN-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H21N3O/c1-17(2)11-8-6-10(7-9-11)16-14(18)12-4-3-5-13(12)15/h6-9,12-13H,3-5,15H2,1-2H3,(H,16,18).
What are the key properties of 2-amino-N-[4-(dimethylamino)phenyl]cyclopentane-1-carboxamide?
2-amino-N-[4-(dimethylamino)phenyl]cyclopentane-1-carboxamide has a molecular weight of 247.34 g/mol, XLogP of 1.82, 3 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-amino-N-[4-(dimethylamino)phenyl]cyclopentane-1-carboxamide is sourced from PubChem (CID 64823318), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).