N-(4,4-dimethylcyclohexyl)-1,5-dimethylpyrrolidin-3-amine

C14H28N2 — CID 81335868

IUPACN-(4,4-dimethylcyclohexyl)-1,5-dimethylpyrrolidin-3-amine
SMILESCC1CC(NC2CCC(C)(C)CC2)CN1C
InChIInChI=1S/C14H28N2/c1-11-9-13(10-16(11)4)15-12-5-7-14(2,3)8-6-12/h11-13,15H,5-10H2,1-4H3
InChIKeyLTHQFJQKUYCACF-UHFFFAOYSA-N
MW224.39 g/mol
LogP2.64
Rot. Bonds2

About N-(4,4-dimethylcyclohexyl)-1,5-dimethylpyrrolidin-3-amine

N-(4,4-dimethylcyclohexyl)-1,5-dimethylpyrrolidin-3-amine (PubChem CID 81335868) has the molecular formula C14H28N2 and a molecular weight of 224.39 g/mol. Its IUPAC name is N-(4,4-dimethylcyclohexyl)-1,5-dimethylpyrrolidin-3-amine.

Molecular Properties

Compound NameN-(4,4-dimethylcyclohexyl)-1,5-dimethylpyrrolidin-3-amine
PubChem CID81335868
Molecular FormulaC14H28N2
Molecular Weight224.39 g/mol
Exact Mass224.23
IUPAC NameN-(4,4-dimethylcyclohexyl)-1,5-dimethylpyrrolidin-3-amine
SMILESCC1CC(NC2CCC(C)(C)CC2)CN1C
InChIInChI=1S/C14H28N2/c1-11-9-13(10-16(11)4)15-12-5-7-14(2,3)8-6-12/h11-13,15H,5-10H2,1-4H3
InChIKeyLTHQFJQKUYCACF-UHFFFAOYSA-N
XLogP2.64
TPSA15.27 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds2
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500224.39
LogP ≤ 52.64
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Related Compounds

N-cyclopropyl-1,5-dimethylpyrrolidin-3-amine
CID 81302091
N-(4-ethylcyclohexyl)-1,5-dimethylpyrrolidin-3-amine
CID 81298687
1,5-dimethyl-N-(4-propylcyclohexyl)pyrrolidin-3-amine
CID 81329081
1-[[(1,5-dimethylpyrrolidin-3-yl)amino]methyl]-4,4-dimethylcyclohexan-1-ol
CID 81468076
N-(1-cyclopropylpyrrolidin-3-yl)-1,5-dimethylpyrrolidin-3-amine
CID 81344811
N-(1,1-dioxothiolan-3-yl)-1,5-dimethylpyrrolidin-3-amine
CID 81300872
1,5-dimethyl-N-(3-methylsulfanylcyclohexyl)pyrrolidin-3-amine
CID 115721214
tert-butyl N-[4-[(1,5-dimethylpyrrolidin-3-yl)amino]cyclohexyl]carbamate
CID 103785646
N-(4,4-dimethylcyclohexyl)-3,4-dimethylcyclohexan-1-amine
CID 64745242
N-(2,3-dimethylcyclohexyl)-1,5-dimethylpyrrolidin-3-amine
CID 81301624
1,5-dimethyl-N-[1-(trifluoromethyl)cyclopropyl]pyrrolidin-3-amine
CID 106210683
1,2-dimethyl-N-(4-methylcyclohexyl)piperidin-4-amine
CID 79032252

Frequently Asked Questions

What is the IUPAC name of N-(4,4-dimethylcyclohexyl)-1,5-dimethylpyrrolidin-3-amine?
The IUPAC name of N-(4,4-dimethylcyclohexyl)-1,5-dimethylpyrrolidin-3-amine (CID 81335868) is N-(4,4-dimethylcyclohexyl)-1,5-dimethylpyrrolidin-3-amine.
What is the SMILES notation for N-(4,4-dimethylcyclohexyl)-1,5-dimethylpyrrolidin-3-amine?
The canonical SMILES for N-(4,4-dimethylcyclohexyl)-1,5-dimethylpyrrolidin-3-amine is CC1CC(NC2CCC(C)(C)CC2)CN1C.
What is the InChIKey of N-(4,4-dimethylcyclohexyl)-1,5-dimethylpyrrolidin-3-amine?
The InChIKey is LTHQFJQKUYCACF-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H28N2/c1-11-9-13(10-16(11)4)15-12-5-7-14(2,3)8-6-12/h11-13,15H,5-10H2,1-4H3.
What are the key properties of N-(4,4-dimethylcyclohexyl)-1,5-dimethylpyrrolidin-3-amine?
N-(4,4-dimethylcyclohexyl)-1,5-dimethylpyrrolidin-3-amine has a molecular weight of 224.39 g/mol, XLogP of 2.64, 2 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N-(4,4-dimethylcyclohexyl)-1,5-dimethylpyrrolidin-3-amine is sourced from PubChem (CID 81335868), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).