N,5-dimethyl-2-[2-methyl-1-(5-methyloxolan-2-yl)propan-2-yl]cyclohexan-1-amine

C17H33NO — CID 103131899

IUPACN,5-dimethyl-2-[2-methyl-1-(5-methyloxolan-2-yl)propan-2-yl]cyclohexan-1-amine
SMILESCNC1CC(C)CCC1C(C)(C)CC1CCC(C)O1
InChIInChI=1S/C17H33NO/c1-12-6-9-15(16(10-12)18-5)17(3,4)11-14-8-7-13(2)19-14/h12-16,18H,6-11H2,1-5H3
InChIKeyKVKXXJRZHJKFEB-UHFFFAOYSA-N
MW267.46 g/mol
LogP3.99
Rot. Bonds4

About N,5-dimethyl-2-[2-methyl-1-(5-methyloxolan-2-yl)propan-2-yl]cyclohexan-1-amine

N,5-dimethyl-2-[2-methyl-1-(5-methyloxolan-2-yl)propan-2-yl]cyclohexan-1-amine (PubChem CID 103131899) has the molecular formula C17H33NO and a molecular weight of 267.46 g/mol. Its IUPAC name is N,5-dimethyl-2-[2-methyl-1-(5-methyloxolan-2-yl)propan-2-yl]cyclohexan-1-amine.

Molecular Properties

Compound NameN,5-dimethyl-2-[2-methyl-1-(5-methyloxolan-2-yl)propan-2-yl]cyclohexan-1-amine
PubChem CID103131899
Molecular FormulaC17H33NO
Molecular Weight267.46 g/mol
Exact Mass267.26
IUPAC NameN,5-dimethyl-2-[2-methyl-1-(5-methyloxolan-2-yl)propan-2-yl]cyclohexan-1-amine
SMILESCNC1CC(C)CCC1C(C)(C)CC1CCC(C)O1
InChIInChI=1S/C17H33NO/c1-12-6-9-15(16(10-12)18-5)17(3,4)11-14-8-7-13(2)19-14/h12-16,18H,6-11H2,1-5H3
InChIKeyKVKXXJRZHJKFEB-UHFFFAOYSA-N
XLogP3.99
TPSA21.26 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds4
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500267.46
LogP ≤ 53.99
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Related Compounds

N,5-dimethyl-2-(2-methyldecan-2-yl)cyclohexan-1-amine
CID 64764075
2-(2,4-dimethylheptan-2-yl)-N,5-dimethylcyclohexan-1-amine
CID 64765922
N,5-dimethyl-2-(2-methylhept-6-en-2-yl)cyclohexan-1-amine
CID 64764257
2-[1-(4-ethylphenyl)-2-methylpropan-2-yl]-N,5-dimethylcyclohexan-1-amine
CID 64764067
N,5-dimethyl-2-[2-methyl-1-(1,3-thiazol-2-yl)propan-2-yl]cyclohexan-1-amine
CID 79825191
2-[1-(3,4-dichlorophenyl)-2-methylpropan-2-yl]-N,5-dimethylcyclohexan-1-amine
CID 64765920
3-methyl-N-[(5-methyloxolan-2-yl)methyl]cyclopentan-1-amine
CID 114543980
2-[2-(bromomethyl)-2-methylbut-3-enyl]-5-methyloxolane
CID 103142758
N-methyl-2-[(5-methyloxolan-2-yl)methyl]cyclopentan-1-amine
CID 103131753
4-methyl-2-[(5-methyloxolan-2-yl)methyl]cyclohexan-1-ol
CID 103137306
N-ethyl-2,2-dimethyl-3-(5-methyloxolan-2-yl)propan-1-amine
CID 103138418
2-methyl-2-[(5-methyloxolan-2-yl)methyl]but-3-en-1-ol
CID 103142539

Frequently Asked Questions

What is the IUPAC name of N,5-dimethyl-2-[2-methyl-1-(5-methyloxolan-2-yl)propan-2-yl]cyclohexan-1-amine?
The IUPAC name of N,5-dimethyl-2-[2-methyl-1-(5-methyloxolan-2-yl)propan-2-yl]cyclohexan-1-amine (CID 103131899) is N,5-dimethyl-2-[2-methyl-1-(5-methyloxolan-2-yl)propan-2-yl]cyclohexan-1-amine.
What is the SMILES notation for N,5-dimethyl-2-[2-methyl-1-(5-methyloxolan-2-yl)propan-2-yl]cyclohexan-1-amine?
The canonical SMILES for N,5-dimethyl-2-[2-methyl-1-(5-methyloxolan-2-yl)propan-2-yl]cyclohexan-1-amine is CNC1CC(C)CCC1C(C)(C)CC1CCC(C)O1.
What is the InChIKey of N,5-dimethyl-2-[2-methyl-1-(5-methyloxolan-2-yl)propan-2-yl]cyclohexan-1-amine?
The InChIKey is KVKXXJRZHJKFEB-UHFFFAOYSA-N. The full InChI is InChI=1S/C17H33NO/c1-12-6-9-15(16(10-12)18-5)17(3,4)11-14-8-7-13(2)19-14/h12-16,18H,6-11H2,1-5H3.
What are the key properties of N,5-dimethyl-2-[2-methyl-1-(5-methyloxolan-2-yl)propan-2-yl]cyclohexan-1-amine?
N,5-dimethyl-2-[2-methyl-1-(5-methyloxolan-2-yl)propan-2-yl]cyclohexan-1-amine has a molecular weight of 267.46 g/mol, XLogP of 3.99, 4 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N,5-dimethyl-2-[2-methyl-1-(5-methyloxolan-2-yl)propan-2-yl]cyclohexan-1-amine is sourced from PubChem (CID 103131899), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).