4-amino-N-[[1-(4-chlorophenyl)cyclobutyl]methyl]butanamide;hydrochloride

C15H22Cl2N2O — CID 119315672

IUPAC4-amino-N-[[1-(4-chlorophenyl)cyclobutyl]methyl]butanamide;hydrochloride
SMILESCl.NCCCC(=O)NCC1(c2ccc(Cl)cc2)CCC1
InChIInChI=1S/C15H21ClN2O.ClH/c16-13-6-4-12(5-7-13)15(8-2-9-15)11-18-14(19)3-1-10-17;/h4-7H,1-3,8-11,17H2,(H,18,19);1H
InChIKeyDJKWMOWPGOXJTP-UHFFFAOYSA-N
MW317.26 g/mol
LogP3.04
Rot. Bonds6

About 4-amino-N-[[1-(4-chlorophenyl)cyclobutyl]methyl]butanamide;hydrochloride

4-amino-N-[[1-(4-chlorophenyl)cyclobutyl]methyl]butanamide;hydrochloride (PubChem CID 119315672) has the molecular formula C15H22Cl2N2O and a molecular weight of 317.26 g/mol. Its IUPAC name is 4-amino-N-[[1-(4-chlorophenyl)cyclobutyl]methyl]butanamide;hydrochloride.

Molecular Properties

Compound Name4-amino-N-[[1-(4-chlorophenyl)cyclobutyl]methyl]butanamide;hydrochloride
PubChem CID119315672
Molecular FormulaC15H22Cl2N2O
Molecular Weight317.26 g/mol
Exact Mass316.11
IUPAC Name4-amino-N-[[1-(4-chlorophenyl)cyclobutyl]methyl]butanamide;hydrochloride
SMILESCl.NCCCC(=O)NCC1(c2ccc(Cl)cc2)CCC1
InChIInChI=1S/C15H21ClN2O.ClH/c16-13-6-4-12(5-7-13)15(8-2-9-15)11-18-14(19)3-1-10-17;/h4-7H,1-3,8-11,17H2,(H,18,19);1H
InChIKeyDJKWMOWPGOXJTP-UHFFFAOYSA-N
XLogP3.04
TPSA55.12 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds6
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500317.26
LogP ≤ 53.04
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 102

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Related Compounds

7-amino-N-[[1-(4-chlorophenyl)cyclobutyl]methyl]heptanamide
CID 119769932
4-amino-N-[[1-(4-tert-butylphenyl)cyclobutyl]methyl]butanamide
CID 119312423
2-chloro-N-[[1-(4-chlorophenyl)cyclobutyl]methyl]acetamide
CID 166404207
3-amino-N-[(1-phenylcyclobutyl)methyl]propanamide
CID 110460227
1-amino-N-[[1-(4-chlorophenyl)cyclobutyl]methyl]cyclopentane-1-carboxamide;hydrochloride
CID 119315664
3-amino-N-[[1-(4-chlorophenyl)cyclobutyl]methyl]-3-phenylpropanamide
CID 119951110
4-amino-N-[1-(4-chlorophenyl)cyclopentyl]butanamide
CID 119313669
2-(4-aminophenyl)-N-[[1-(4-chlorophenyl)cyclopropyl]methyl]acetamide;hydrochloride
CID 119772654
4-(aminomethyl)-N-[[1-(4-chlorophenyl)cyclobutyl]methyl]oxane-4-carboxamide
CID 120930589
1-amino-N-[[1-(4-chlorophenyl)cyclopropyl]methyl]cyclohexane-1-carboxamide;hydrochloride
CID 119317240
3-amino-N-[(1-phenylcyclopropyl)methyl]propanamide
CID 110460210
N-[[1-(4-chlorophenyl)cyclobutyl]methyl]-2-(6-oxo-1H-pyridin-3-yl)acetamide
CID 122154894

Frequently Asked Questions

What is the IUPAC name of 4-amino-N-[[1-(4-chlorophenyl)cyclobutyl]methyl]butanamide;hydrochloride?
The IUPAC name of 4-amino-N-[[1-(4-chlorophenyl)cyclobutyl]methyl]butanamide;hydrochloride (CID 119315672) is 4-amino-N-[[1-(4-chlorophenyl)cyclobutyl]methyl]butanamide;hydrochloride.
What is the SMILES notation for 4-amino-N-[[1-(4-chlorophenyl)cyclobutyl]methyl]butanamide;hydrochloride?
The canonical SMILES for 4-amino-N-[[1-(4-chlorophenyl)cyclobutyl]methyl]butanamide;hydrochloride is Cl.NCCCC(=O)NCC1(c2ccc(Cl)cc2)CCC1.
What is the InChIKey of 4-amino-N-[[1-(4-chlorophenyl)cyclobutyl]methyl]butanamide;hydrochloride?
The InChIKey is DJKWMOWPGOXJTP-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H21ClN2O.ClH/c16-13-6-4-12(5-7-13)15(8-2-9-15)11-18-14(19)3-1-10-17;/h4-7H,1-3,8-11,17H2,(H,18,19);1H.
What are the key properties of 4-amino-N-[[1-(4-chlorophenyl)cyclobutyl]methyl]butanamide;hydrochloride?
4-amino-N-[[1-(4-chlorophenyl)cyclobutyl]methyl]butanamide;hydrochloride has a molecular weight of 317.26 g/mol, XLogP of 3.04, 6 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 4-amino-N-[[1-(4-chlorophenyl)cyclobutyl]methyl]butanamide;hydrochloride is sourced from PubChem (CID 119315672), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).