N-[(2-cyclopentylcycloheptyl)methyl]-2-methylpropan-2-amine

C17H33N — CID 81025228

IUPACN-[(2-cyclopentylcycloheptyl)methyl]-2-methylpropan-2-amine
SMILESCC(C)(C)NCC1CCCCCC1C1CCCC1
InChIInChI=1S/C17H33N/c1-17(2,3)18-13-15-11-5-4-6-12-16(15)14-9-7-8-10-14/h14-16,18H,4-13H2,1-3H3
InChIKeyZYRSNTSAYQFSDP-UHFFFAOYSA-N
MW251.46 g/mol
LogP4.76
Rot. Bonds3

About N-[(2-cyclopentylcycloheptyl)methyl]-2-methylpropan-2-amine

N-[(2-cyclopentylcycloheptyl)methyl]-2-methylpropan-2-amine (PubChem CID 81025228) has the molecular formula C17H33N and a molecular weight of 251.46 g/mol. Its IUPAC name is N-[(2-cyclopentylcycloheptyl)methyl]-2-methylpropan-2-amine.

Molecular Properties

Compound NameN-[(2-cyclopentylcycloheptyl)methyl]-2-methylpropan-2-amine
PubChem CID81025228
Molecular FormulaC17H33N
Molecular Weight251.46 g/mol
Exact Mass251.26
IUPAC NameN-[(2-cyclopentylcycloheptyl)methyl]-2-methylpropan-2-amine
SMILESCC(C)(C)NCC1CCCCCC1C1CCCC1
InChIInChI=1S/C17H33N/c1-17(2,3)18-13-15-11-5-4-6-12-16(15)14-9-7-8-10-14/h14-16,18H,4-13H2,1-3H3
InChIKeyZYRSNTSAYQFSDP-UHFFFAOYSA-N
XLogP4.76
TPSA12.03 Ų
H-Bond Donors1
H-Bond Acceptors1
Rotatable Bonds3
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500251.46
LogP ≤ 54.76
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 101

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Related Compounds

N-[[2-(4-ethylcyclohexyl)cyclopentyl]methyl]-2-methylpropan-2-amine
CID 81028892
2-methyl-N-[[2-(3-methylcyclohexyl)cyclopentyl]methyl]propan-2-amine
CID 81026999
1-(2-cyclohexylcycloheptyl)-N-methylmethanamine
CID 81025955
1-(2-cyclohexylcyclopentyl)-N-methylmethanamine
CID 81033950
N-[(2-cycloheptylcycloheptyl)methyl]cyclopropanamine
CID 82935728
N-[(2-cyclohexylcycloheptyl)methyl]propan-1-amine
CID 81026009
2-methyl-N-(4-tetracyclo[12.4.0.02,6.07,12]octadecanylmethyl)propan-2-amine
CID 59100363
N-[(4-tert-butyl-2-cyclopropylcyclohexyl)methyl]-2-methylpropan-2-amine
CID 81030772
1-(2-cyclohexylcyclobutyl)-N-methylmethanamine
CID 81017372
2-methyl-N-[[2-(2-methylpropyl)cyclohexyl]methyl]propan-2-amine
CID 81024627
N-[(2-cyclopentyloxolan-3-yl)methyl]-2-methylpropan-2-amine
CID 79367525
N-(cyclohexylmethyl)-2-methylpropan-2-amine;methane
CID 159032634

Frequently Asked Questions

What is the IUPAC name of N-[(2-cyclopentylcycloheptyl)methyl]-2-methylpropan-2-amine?
The IUPAC name of N-[(2-cyclopentylcycloheptyl)methyl]-2-methylpropan-2-amine (CID 81025228) is N-[(2-cyclopentylcycloheptyl)methyl]-2-methylpropan-2-amine.
What is the SMILES notation for N-[(2-cyclopentylcycloheptyl)methyl]-2-methylpropan-2-amine?
The canonical SMILES for N-[(2-cyclopentylcycloheptyl)methyl]-2-methylpropan-2-amine is CC(C)(C)NCC1CCCCCC1C1CCCC1.
What is the InChIKey of N-[(2-cyclopentylcycloheptyl)methyl]-2-methylpropan-2-amine?
The InChIKey is ZYRSNTSAYQFSDP-UHFFFAOYSA-N. The full InChI is InChI=1S/C17H33N/c1-17(2,3)18-13-15-11-5-4-6-12-16(15)14-9-7-8-10-14/h14-16,18H,4-13H2,1-3H3.
What are the key properties of N-[(2-cyclopentylcycloheptyl)methyl]-2-methylpropan-2-amine?
N-[(2-cyclopentylcycloheptyl)methyl]-2-methylpropan-2-amine has a molecular weight of 251.46 g/mol, XLogP of 4.76, 3 rotatable bonds, 1 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for N-[(2-cyclopentylcycloheptyl)methyl]-2-methylpropan-2-amine is sourced from PubChem (CID 81025228), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).