N-[(1S)-1-cyclohexylethyl]-1-cyclopropylpyrrolidin-3-amine

C15H28N2 — CID 81387724

IUPACN-[(1S)-1-cyclohexylethyl]-1-cyclopropylpyrrolidin-3-amine
SMILESC[C@H](NC1CCN(C2CC2)C1)C1CCCCC1
InChIInChI=1S/C15H28N2/c1-12(13-5-3-2-4-6-13)16-14-9-10-17(11-14)15-7-8-15/h12-16H,2-11H2,1H3/t12-,14?/m0/s1
InChIKeyRIYNHTRELFOTOR-NBFOIZRFSA-N
MW236.40 g/mol
LogP2.78
Rot. Bonds4

About N-[(1S)-1-cyclohexylethyl]-1-cyclopropylpyrrolidin-3-amine

N-[(1S)-1-cyclohexylethyl]-1-cyclopropylpyrrolidin-3-amine (PubChem CID 81387724) has the molecular formula C15H28N2 and a molecular weight of 236.40 g/mol. Its IUPAC name is N-[(1S)-1-cyclohexylethyl]-1-cyclopropylpyrrolidin-3-amine.

Molecular Properties

Compound NameN-[(1S)-1-cyclohexylethyl]-1-cyclopropylpyrrolidin-3-amine
PubChem CID81387724
Molecular FormulaC15H28N2
Molecular Weight236.40 g/mol
Exact Mass236.23
IUPAC NameN-[(1S)-1-cyclohexylethyl]-1-cyclopropylpyrrolidin-3-amine
SMILESC[C@H](NC1CCN(C2CC2)C1)C1CCCCC1
InChIInChI=1S/C15H28N2/c1-12(13-5-3-2-4-6-13)16-14-9-10-17(11-14)15-7-8-15/h12-16H,2-11H2,1H3/t12-,14?/m0/s1
InChIKeyRIYNHTRELFOTOR-NBFOIZRFSA-N
XLogP2.78
TPSA15.27 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds4
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500236.40
LogP ≤ 52.78
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Related Compounds

N-[(1S)-1-cycloheptylethyl]-1-methylpyrrolidin-3-amine
CID 81391420
N-(1-cyclohexylethyl)-1-methylpyrrolidin-3-amine
CID 61462202
1-cycloheptyl-N-methylpyrrolidin-3-amine
CID 43315596
N-[(1S)-1-cycloheptylethyl]cycloheptanamine
CID 81389840
N-but-3-en-2-yl-1-cyclopropylpyrrolidin-3-amine
CID 115727974
N-[(1S)-1-cyclopentylethyl]-1-methylpiperidin-4-amine
CID 81386748
N-(1-cyclobutylethyl)-1-propan-2-ylpyrrolidin-3-amine
CID 115717125
1-cyclopropyl-N-[1-(1-propylpiperidin-4-yl)ethyl]piperidin-4-amine
CID 43746999
N-(1-cyclopropylethyl)cyclohexanamine
CID 43177177
N-[(1R)-1-cycloheptylethyl]-1-ethylpiperidin-4-amine
CID 81391096
(4R)-4-[[(3R)-1-cyclopentylpyrrolidin-3-yl]amino]pentan-1-ol
CID 99852107
(4R)-4-[[(3S)-1-cyclopentylpyrrolidin-3-yl]amino]pentan-1-ol
CID 99852109

Frequently Asked Questions

What is the IUPAC name of N-[(1S)-1-cyclohexylethyl]-1-cyclopropylpyrrolidin-3-amine?
The IUPAC name of N-[(1S)-1-cyclohexylethyl]-1-cyclopropylpyrrolidin-3-amine (CID 81387724) is N-[(1S)-1-cyclohexylethyl]-1-cyclopropylpyrrolidin-3-amine.
What is the SMILES notation for N-[(1S)-1-cyclohexylethyl]-1-cyclopropylpyrrolidin-3-amine?
The canonical SMILES for N-[(1S)-1-cyclohexylethyl]-1-cyclopropylpyrrolidin-3-amine is C[C@H](NC1CCN(C2CC2)C1)C1CCCCC1.
What is the InChIKey of N-[(1S)-1-cyclohexylethyl]-1-cyclopropylpyrrolidin-3-amine?
The InChIKey is RIYNHTRELFOTOR-NBFOIZRFSA-N. The full InChI is InChI=1S/C15H28N2/c1-12(13-5-3-2-4-6-13)16-14-9-10-17(11-14)15-7-8-15/h12-16H,2-11H2,1H3/t12-,14?/m0/s1.
What are the key properties of N-[(1S)-1-cyclohexylethyl]-1-cyclopropylpyrrolidin-3-amine?
N-[(1S)-1-cyclohexylethyl]-1-cyclopropylpyrrolidin-3-amine has a molecular weight of 236.40 g/mol, XLogP of 2.78, 4 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N-[(1S)-1-cyclohexylethyl]-1-cyclopropylpyrrolidin-3-amine is sourced from PubChem (CID 81387724), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).