N-[(4-propylphenyl)methyl]cyclohexanamine

C16H25N — CID 94685509

IUPACN-[(4-propylphenyl)methyl]cyclohexanamine
SMILESCCCc1ccc(CNC2CCCCC2)cc1
InChIInChI=1S/C16H25N/c1-2-6-14-9-11-15(12-10-14)13-17-16-7-4-3-5-8-16/h9-12,16-17H,2-8,13H2,1H3
InChIKeyOWEUHDKMVAZZMA-UHFFFAOYSA-N
MW231.38 g/mol
LogP4.06
Rot. Bonds5

About N-[(4-propylphenyl)methyl]cyclohexanamine

N-[(4-propylphenyl)methyl]cyclohexanamine (PubChem CID 94685509) has the molecular formula C16H25N and a molecular weight of 231.38 g/mol. Its IUPAC name is N-[(4-propylphenyl)methyl]cyclohexanamine.

Molecular Properties

Compound NameN-[(4-propylphenyl)methyl]cyclohexanamine
PubChem CID94685509
Molecular FormulaC16H25N
Molecular Weight231.38 g/mol
Exact Mass231.20
IUPAC NameN-[(4-propylphenyl)methyl]cyclohexanamine
SMILESCCCc1ccc(CNC2CCCCC2)cc1
InChIInChI=1S/C16H25N/c1-2-6-14-9-11-15(12-10-14)13-17-16-7-4-3-5-8-16/h9-12,16-17H,2-8,13H2,1H3
InChIKeyOWEUHDKMVAZZMA-UHFFFAOYSA-N
XLogP4.06
TPSA12.03 Ų
H-Bond Donors1
H-Bond Acceptors1
Rotatable Bonds5
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500231.38
LogP ≤ 54.06
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 101

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Related Compounds

N-[(4-butylphenyl)methyl]cyclohexanamine
CID 70837938
N-[(4-butylphenyl)methyl]cyclobutanamine
CID 98783334
N-[(4-tert-butylphenyl)methyl]cycloheptanamine
CID 28509997
N-[(4-ethoxyphenyl)methyl]cyclooctanamine;hydrochloride
CID 17331532
N-[[4-(diethylamino)phenyl]methyl]cycloheptanamine
CID 4719916
N-[(4-methoxyphenyl)methyl]cycloheptanamine
CID 784052
N-[(4-methylsulfanylphenyl)methyl]cycloheptanamine
CID 4722425
benzene;N-benzylcyclohexanamine
CID 142622843
2-N-[(4-bromophenyl)methyl]-1-N-[(4-propylphenyl)methyl]cyclohexane-1,2-diamine
CID 71500072
1-N-[(4-methylphenyl)methyl]-2-N-[(4-propylphenyl)methyl]cyclohexane-1,2-diamine;dihydrochloride
CID 71502123
N-[2-(4-propylphenoxy)propyl]cyclohexanamine
CID 63515427
N-[(4-bromophenyl)methyl]cycloheptanamine;hydrochloride
CID 17294485

Frequently Asked Questions

What is the IUPAC name of N-[(4-propylphenyl)methyl]cyclohexanamine?
The IUPAC name of N-[(4-propylphenyl)methyl]cyclohexanamine (CID 94685509) is N-[(4-propylphenyl)methyl]cyclohexanamine.
What is the SMILES notation for N-[(4-propylphenyl)methyl]cyclohexanamine?
The canonical SMILES for N-[(4-propylphenyl)methyl]cyclohexanamine is CCCc1ccc(CNC2CCCCC2)cc1.
What is the InChIKey of N-[(4-propylphenyl)methyl]cyclohexanamine?
The InChIKey is OWEUHDKMVAZZMA-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H25N/c1-2-6-14-9-11-15(12-10-14)13-17-16-7-4-3-5-8-16/h9-12,16-17H,2-8,13H2,1H3.
What are the key properties of N-[(4-propylphenyl)methyl]cyclohexanamine?
N-[(4-propylphenyl)methyl]cyclohexanamine has a molecular weight of 231.38 g/mol, XLogP of 4.06, 5 rotatable bonds, 1 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for N-[(4-propylphenyl)methyl]cyclohexanamine is sourced from PubChem (CID 94685509), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).