2-cycloheptyl-2-methylcycloheptan-1-amine

C15H29N — CID 160840107

IUPAC2-cycloheptyl-2-methylcycloheptan-1-amine
SMILESCC1(C2CCCCCC2)CCCCCC1N
InChIInChI=1S/C15H29N/c1-15(12-8-4-7-11-14(15)16)13-9-5-2-3-6-10-13/h13-14H,2-12,16H2,1H3
InChIKeySHXLPLBBHOKBCO-UHFFFAOYSA-N
MW223.40 g/mol
LogP4.25
Rot. Bonds1

About 2-cycloheptyl-2-methylcycloheptan-1-amine

2-cycloheptyl-2-methylcycloheptan-1-amine (PubChem CID 160840107) has the molecular formula C15H29N and a molecular weight of 223.40 g/mol. Its IUPAC name is 2-cycloheptyl-2-methylcycloheptan-1-amine.

Molecular Properties

Compound Name2-cycloheptyl-2-methylcycloheptan-1-amine
PubChem CID160840107
Molecular FormulaC15H29N
Molecular Weight223.40 g/mol
Exact Mass223.23
IUPAC Name2-cycloheptyl-2-methylcycloheptan-1-amine
SMILESCC1(C2CCCCCC2)CCCCCC1N
InChIInChI=1S/C15H29N/c1-15(12-8-4-7-11-14(15)16)13-9-5-2-3-6-10-13/h13-14H,2-12,16H2,1H3
InChIKeySHXLPLBBHOKBCO-UHFFFAOYSA-N
XLogP4.25
TPSA26.02 Ų
H-Bond Donors1
H-Bond Acceptors1
Rotatable Bonds1
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500223.40
LogP ≤ 54.25
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 101

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Related Compounds

1,2-dicyclohexyl-1-methylcyclohexane
CID 173420914
(1-methylcyclopentyl)cyclohexane
CID 13217819
spiro[5.6]dodecan-12-amine
CID 15021866
trans-(1S,2R)-2-amino-1-methylcyclohexan-1-ol
CID 10964528
(7aR)-1,7a-dimethyl-1,2,3,3a,4,5,6,7-octahydroindene;ethane;methane
CID 142069043
(5R,17S)-17-amino-10,13-dimethyl-2,3,4,5,6,7,8,9,11,12,14,15,16,17-tetradecahydro-1H-cyclopenta[a]phenanthren-11-ol
CID 21879
2-(7a-methyl-1,2,3,3a,4,5,6,7-octahydroinden-1-yl)ethanol;ethane
CID 142091721
1-cyclohexyl-1,2-dimethylcyclohexane;1,1-diaminourea;methane
CID 174842963
2-amino-1-methylcycloheptane-1-carboxylic acid
CID 67314913
7a-methyl-1-propan-2-yl-1,2,3,3a,4,5,6,7-octahydroindene;ethane
CID 171514163
trans-(1S,2R)-2-amino-1-methylcycloheptane-1-carboxylic acid
CID 67314910
8a-methyl-2,3,4,4a,5,6,7,8-octahydro-1H-naphthalene-1-carbaldehyde
CID 130035655

Frequently Asked Questions

What is the IUPAC name of 2-cycloheptyl-2-methylcycloheptan-1-amine?
The IUPAC name of 2-cycloheptyl-2-methylcycloheptan-1-amine (CID 160840107) is 2-cycloheptyl-2-methylcycloheptan-1-amine.
What is the SMILES notation for 2-cycloheptyl-2-methylcycloheptan-1-amine?
The canonical SMILES for 2-cycloheptyl-2-methylcycloheptan-1-amine is CC1(C2CCCCCC2)CCCCCC1N.
What is the InChIKey of 2-cycloheptyl-2-methylcycloheptan-1-amine?
The InChIKey is SHXLPLBBHOKBCO-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H29N/c1-15(12-8-4-7-11-14(15)16)13-9-5-2-3-6-10-13/h13-14H,2-12,16H2,1H3.
What are the key properties of 2-cycloheptyl-2-methylcycloheptan-1-amine?
2-cycloheptyl-2-methylcycloheptan-1-amine has a molecular weight of 223.40 g/mol, XLogP of 4.25, 1 rotatable bonds, 1 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for 2-cycloheptyl-2-methylcycloheptan-1-amine is sourced from PubChem (CID 160840107), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).