4,4-dimethyl-N-(1-pyrrolidin-2-ylpropan-2-yl)cyclohexan-1-amine

C15H30N2 — CID 79541757

IUPAC4,4-dimethyl-N-(1-pyrrolidin-2-ylpropan-2-yl)cyclohexan-1-amine
SMILESCC(CC1CCCN1)NC1CCC(C)(C)CC1
InChIInChI=1S/C15H30N2/c1-12(11-14-5-4-10-16-14)17-13-6-8-15(2,3)9-7-13/h12-14,16-17H,4-11H2,1-3H3
InChIKeyVPWRDQYYYOOZAD-UHFFFAOYSA-N
MW238.42 g/mol
LogP3.08
Rot. Bonds4

About 4,4-dimethyl-N-(1-pyrrolidin-2-ylpropan-2-yl)cyclohexan-1-amine

4,4-dimethyl-N-(1-pyrrolidin-2-ylpropan-2-yl)cyclohexan-1-amine (PubChem CID 79541757) has the molecular formula C15H30N2 and a molecular weight of 238.42 g/mol. Its IUPAC name is 4,4-dimethyl-N-(1-pyrrolidin-2-ylpropan-2-yl)cyclohexan-1-amine.

Molecular Properties

Compound Name4,4-dimethyl-N-(1-pyrrolidin-2-ylpropan-2-yl)cyclohexan-1-amine
PubChem CID79541757
Molecular FormulaC15H30N2
Molecular Weight238.42 g/mol
Exact Mass238.24
IUPAC Name4,4-dimethyl-N-(1-pyrrolidin-2-ylpropan-2-yl)cyclohexan-1-amine
SMILESCC(CC1CCCN1)NC1CCC(C)(C)CC1
InChIInChI=1S/C15H30N2/c1-12(11-14-5-4-10-16-14)17-13-6-8-15(2,3)9-7-13/h12-14,16-17H,4-11H2,1-3H3
InChIKeyVPWRDQYYYOOZAD-UHFFFAOYSA-N
XLogP3.08
TPSA24.06 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds4
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500238.42
LogP ≤ 53.08
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 102

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Related Compounds

4-methyl-N-(1-pyrrolidin-2-ylpropan-2-yl)cyclohexan-1-amine
CID 79541223
N-(1-piperidin-2-ylpropan-2-yl)cyclohexanamine
CID 79549011
N-[1-(azepan-2-yl)propan-2-yl]-3,3,5,5-tetramethylcyclohexan-1-amine
CID 103965789
N-(1-pyrrolidin-2-ylpropan-2-yl)-4-(trifluoromethyl)cyclohexan-1-amine
CID 79541274
2,2,3,3-tetramethyl-N-(1-piperidin-2-ylpropan-2-yl)cyclopropan-1-amine
CID 79539151
N-[1-(azepan-2-yl)propan-2-yl]-2,2,3,3-tetramethylcyclopropan-1-amine
CID 79560325
N-(1-piperidin-2-ylpropan-2-yl)-4-propylcyclohexan-1-amine
CID 79538652
1-cyclopropyl-N-(1-piperidin-2-ylpropan-2-yl)piperidin-4-amine
CID 79538874
1,1-dioxo-N-(1-pyrrolidin-2-ylpropan-2-yl)thian-3-amine
CID 79540198
N-(1-piperidin-2-ylpropan-2-yl)-1-propylpiperidin-4-amine
CID 79549171
N-[(1S)-1-cyclopentylethyl]-1-pyrrolidin-2-ylpropan-2-amine
CID 81386567
2,3-dimethyl-N-(1-pyrrolidin-2-ylpropan-2-yl)cyclopentan-1-amine
CID 79541319

Frequently Asked Questions

What is the IUPAC name of 4,4-dimethyl-N-(1-pyrrolidin-2-ylpropan-2-yl)cyclohexan-1-amine?
The IUPAC name of 4,4-dimethyl-N-(1-pyrrolidin-2-ylpropan-2-yl)cyclohexan-1-amine (CID 79541757) is 4,4-dimethyl-N-(1-pyrrolidin-2-ylpropan-2-yl)cyclohexan-1-amine.
What is the SMILES notation for 4,4-dimethyl-N-(1-pyrrolidin-2-ylpropan-2-yl)cyclohexan-1-amine?
The canonical SMILES for 4,4-dimethyl-N-(1-pyrrolidin-2-ylpropan-2-yl)cyclohexan-1-amine is CC(CC1CCCN1)NC1CCC(C)(C)CC1.
What is the InChIKey of 4,4-dimethyl-N-(1-pyrrolidin-2-ylpropan-2-yl)cyclohexan-1-amine?
The InChIKey is VPWRDQYYYOOZAD-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H30N2/c1-12(11-14-5-4-10-16-14)17-13-6-8-15(2,3)9-7-13/h12-14,16-17H,4-11H2,1-3H3.
What are the key properties of 4,4-dimethyl-N-(1-pyrrolidin-2-ylpropan-2-yl)cyclohexan-1-amine?
4,4-dimethyl-N-(1-pyrrolidin-2-ylpropan-2-yl)cyclohexan-1-amine has a molecular weight of 238.42 g/mol, XLogP of 3.08, 4 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 4,4-dimethyl-N-(1-pyrrolidin-2-ylpropan-2-yl)cyclohexan-1-amine is sourced from PubChem (CID 79541757), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).