(1-benzylcycloheptyl)methanamine

C15H23N — CID 65391702

IUPAC(1-benzylcycloheptyl)methanamine
SMILESNCC1(Cc2ccccc2)CCCCCC1
InChIInChI=1S/C15H23N/c16-13-15(10-6-1-2-7-11-15)12-14-8-4-3-5-9-14/h3-5,8-9H,1-2,6-7,10-13,16H2
InChIKeyRUAYLWRVTVLPHD-UHFFFAOYSA-N
MW217.36 g/mol
LogP3.53
Rot. Bonds3

About (1-benzylcycloheptyl)methanamine

(1-benzylcycloheptyl)methanamine (PubChem CID 65391702) has the molecular formula C15H23N and a molecular weight of 217.36 g/mol. Its IUPAC name is (1-benzylcycloheptyl)methanamine.

Molecular Properties

Compound Name(1-benzylcycloheptyl)methanamine
PubChem CID65391702
Molecular FormulaC15H23N
Molecular Weight217.36 g/mol
Exact Mass217.18
IUPAC Name(1-benzylcycloheptyl)methanamine
SMILESNCC1(Cc2ccccc2)CCCCCC1
InChIInChI=1S/C15H23N/c16-13-15(10-6-1-2-7-11-15)12-14-8-4-3-5-9-14/h3-5,8-9H,1-2,6-7,10-13,16H2
InChIKeyRUAYLWRVTVLPHD-UHFFFAOYSA-N
XLogP3.53
TPSA26.02 Ų
H-Bond Donors1
H-Bond Acceptors1
Rotatable Bonds3
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500217.36
LogP ≤ 53.53
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 101

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Related Compounds

(1-benzylcyclooctyl)methanamine
CID 80602159
(1-benzylcyclopropyl)methanamine;hydrochloride
CID 86277151
[4-[[1-(aminomethyl)cyclopentyl]methyl]phenyl]methanol
CID 18999623
(3-benzylpyrrolidin-3-yl)methanamine
CID 142188778
[3-(aminomethyl)-3-benzylcyclohexyl]methanamine
CID 154699226
[1-[(3-methoxyphenyl)methyl]cyclooctyl]methanamine
CID 80603141
[1-(naphthalen-1-ylmethyl)cycloheptyl]methanamine
CID 65391703
[1-[[4-(trifluoromethyl)phenyl]methyl]cyclopentyl]methanamine
CID 62725893
2-[[1-(aminomethyl)cyclopentyl]methyl]phenol
CID 105458102
N-[[1-(aminomethyl)cyclohexyl]methyl]aniline
CID 115438130
[1-[(3,4-dichlorophenyl)methyl]cyclohexyl]methanamine
CID 63522504
[1-[(3,4-dichlorophenyl)methyl]cycloheptyl]methanamine
CID 65390706

Frequently Asked Questions

What is the IUPAC name of (1-benzylcycloheptyl)methanamine?
The IUPAC name of (1-benzylcycloheptyl)methanamine (CID 65391702) is (1-benzylcycloheptyl)methanamine.
What is the SMILES notation for (1-benzylcycloheptyl)methanamine?
The canonical SMILES for (1-benzylcycloheptyl)methanamine is NCC1(Cc2ccccc2)CCCCCC1.
What is the InChIKey of (1-benzylcycloheptyl)methanamine?
The InChIKey is RUAYLWRVTVLPHD-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H23N/c16-13-15(10-6-1-2-7-11-15)12-14-8-4-3-5-9-14/h3-5,8-9H,1-2,6-7,10-13,16H2.
What are the key properties of (1-benzylcycloheptyl)methanamine?
(1-benzylcycloheptyl)methanamine has a molecular weight of 217.36 g/mol, XLogP of 3.53, 3 rotatable bonds, 1 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for (1-benzylcycloheptyl)methanamine is sourced from PubChem (CID 65391702), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).