1-methyl-N-(2-propan-2-ylcyclohexyl)pyrrolidin-3-amine

C14H28N2 — CID 81344224

IUPAC1-methyl-N-(2-propan-2-ylcyclohexyl)pyrrolidin-3-amine
SMILESCC(C)C1CCCCC1NC1CCN(C)C1
InChIInChI=1S/C14H28N2/c1-11(2)13-6-4-5-7-14(13)15-12-8-9-16(3)10-12/h11-15H,4-10H2,1-3H3
InChIKeyDCQNRJYAVCYSCX-UHFFFAOYSA-N
MW224.39 g/mol
LogP2.49
Rot. Bonds3

About 1-methyl-N-(2-propan-2-ylcyclohexyl)pyrrolidin-3-amine

1-methyl-N-(2-propan-2-ylcyclohexyl)pyrrolidin-3-amine (PubChem CID 81344224) has the molecular formula C14H28N2 and a molecular weight of 224.39 g/mol. Its IUPAC name is 1-methyl-N-(2-propan-2-ylcyclohexyl)pyrrolidin-3-amine.

Molecular Properties

Compound Name1-methyl-N-(2-propan-2-ylcyclohexyl)pyrrolidin-3-amine
PubChem CID81344224
Molecular FormulaC14H28N2
Molecular Weight224.39 g/mol
Exact Mass224.23
IUPAC Name1-methyl-N-(2-propan-2-ylcyclohexyl)pyrrolidin-3-amine
SMILESCC(C)C1CCCCC1NC1CCN(C)C1
InChIInChI=1S/C14H28N2/c1-11(2)13-6-4-5-7-14(13)15-12-8-9-16(3)10-12/h11-15H,4-10H2,1-3H3
InChIKeyDCQNRJYAVCYSCX-UHFFFAOYSA-N
XLogP2.49
TPSA15.27 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds3
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500224.39
LogP ≤ 52.49
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Related Compounds

2-[(1-methylpyrrolidin-3-yl)amino]cyclohexan-1-ol
CID 61462250
(3S)-1-methyl-N-[(1S,2R)-2-methylcyclohexyl]pyrrolidin-3-amine
CID 124708701
trans-(1R,2S)-2-propan-2-yl-N-[(1S,2S)-2-propan-2-ylcyclohexyl]cyclohexan-1-amine
CID 124709501
1-methyl-N-(2-methylcyclopentyl)pyrrolidin-3-amine
CID 63278241
1-methyl-N-(3-propan-2-ylcyclohexyl)pyrrolidin-3-amine
CID 103748264
3-[(2-propan-2-ylcyclohexyl)amino]cyclohexan-1-ol
CID 81328282
N-[(1S)-1-cycloheptylethyl]-1-methylpyrrolidin-3-amine
CID 81391420
N-(1-cyclohexylethyl)-1-methylpyrrolidin-3-amine
CID 61462202
1-methyl-1-[[(3R)-1-methylpyrrolidin-3-yl]methyl]-3-[(1R,2S)-2-propan-2-ylcyclohexyl]urea
CID 95977894
1-methyl-1-[[(3S)-1-methylpyrrolidin-3-yl]methyl]-3-[(1R,2S)-2-propan-2-ylcyclohexyl]urea
CID 124865822
N-fluoro-2-propan-2-ylcyclohexan-1-amine
CID 142212218
(3S,4R)-1-methyl-4-propan-2-ylpiperidin-3-ol
CID 121424108

Frequently Asked Questions

What is the IUPAC name of 1-methyl-N-(2-propan-2-ylcyclohexyl)pyrrolidin-3-amine?
The IUPAC name of 1-methyl-N-(2-propan-2-ylcyclohexyl)pyrrolidin-3-amine (CID 81344224) is 1-methyl-N-(2-propan-2-ylcyclohexyl)pyrrolidin-3-amine.
What is the SMILES notation for 1-methyl-N-(2-propan-2-ylcyclohexyl)pyrrolidin-3-amine?
The canonical SMILES for 1-methyl-N-(2-propan-2-ylcyclohexyl)pyrrolidin-3-amine is CC(C)C1CCCCC1NC1CCN(C)C1.
What is the InChIKey of 1-methyl-N-(2-propan-2-ylcyclohexyl)pyrrolidin-3-amine?
The InChIKey is DCQNRJYAVCYSCX-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H28N2/c1-11(2)13-6-4-5-7-14(13)15-12-8-9-16(3)10-12/h11-15H,4-10H2,1-3H3.
What are the key properties of 1-methyl-N-(2-propan-2-ylcyclohexyl)pyrrolidin-3-amine?
1-methyl-N-(2-propan-2-ylcyclohexyl)pyrrolidin-3-amine has a molecular weight of 224.39 g/mol, XLogP of 2.49, 3 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 1-methyl-N-(2-propan-2-ylcyclohexyl)pyrrolidin-3-amine is sourced from PubChem (CID 81344224), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).