N-methyl-1-(2-phenylcyclohexyl)pyrrolidin-3-amine

C17H26N2 — CID 105402237

IUPACN-methyl-1-(2-phenylcyclohexyl)pyrrolidin-3-amine
SMILESCNC1CCN(C2CCCCC2c2ccccc2)C1
InChIInChI=1S/C17H26N2/c1-18-15-11-12-19(13-15)17-10-6-5-9-16(17)14-7-3-2-4-8-14/h2-4,7-8,15-18H,5-6,9-13H2,1H3
InChIKeyQOYNTBCXODSFQH-UHFFFAOYSA-N
MW258.41 g/mol
LogP3.01
Rot. Bonds3

About N-methyl-1-(2-phenylcyclohexyl)pyrrolidin-3-amine

N-methyl-1-(2-phenylcyclohexyl)pyrrolidin-3-amine (PubChem CID 105402237) has the molecular formula C17H26N2 and a molecular weight of 258.41 g/mol. Its IUPAC name is N-methyl-1-(2-phenylcyclohexyl)pyrrolidin-3-amine.

Molecular Properties

Compound NameN-methyl-1-(2-phenylcyclohexyl)pyrrolidin-3-amine
PubChem CID105402237
Molecular FormulaC17H26N2
Molecular Weight258.41 g/mol
Exact Mass258.21
IUPAC NameN-methyl-1-(2-phenylcyclohexyl)pyrrolidin-3-amine
SMILESCNC1CCN(C2CCCCC2c2ccccc2)C1
InChIInChI=1S/C17H26N2/c1-18-15-11-12-19(13-15)17-10-6-5-9-16(17)14-7-3-2-4-8-14/h2-4,7-8,15-18H,5-6,9-13H2,1H3
InChIKeyQOYNTBCXODSFQH-UHFFFAOYSA-N
XLogP3.01
TPSA15.27 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds3
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500258.41
LogP ≤ 53.01
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Related Compounds

1-(2-phenylcyclohexyl)piperidin-3-amine
CID 105402048
2-[(2R)-2-methyl-4-(2-phenylcyclohexyl)piperazin-1-yl]acetic acid
CID 59590179
4-amino-N-methyl-1-[(2S)-2-phenylcyclohexyl]piperidine-4-carboxamide
CID 163920403
1-(2-ethylcyclohexyl)-N-methylpyrrolidin-3-amine
CID 61470287
3-ethyl-1-phenyl-1,2,3,4,6,7,8,9,10,10a-decahydropyrido[1,2-a]azepine
CID 10445204
N-methyl-1-(9H-xanthen-9-yl)pyrrolidin-3-amine
CID 115300061
1-[(1R,2R)-2-phenylcyclohexyl]-4-(propan-2-ylamino)piperidine-4-carbonitrile
CID 69487621
N-methyl-1-(13-tricyclo[8.2.1.03,8]trideca-3,5,7-trienyl)pyrrolidin-3-amine
CID 115299892
1-cycloheptyl-N-methylpyrrolidin-3-amine
CID 43315596
1-(2-phenylcyclohexyl)-4-(propan-2-ylamino)piperidine-4-carboxamide
CID 69486342
2-(2-phenylcyclopropyl)-1,3,4,6,7,8,9,9a-octahydropyrido[1,2-a]pyrazine
CID 79929782
azane;3-methyl-1-(2-phenylcyclopropyl)piperidine
CID 174742759

Frequently Asked Questions

What is the IUPAC name of N-methyl-1-(2-phenylcyclohexyl)pyrrolidin-3-amine?
The IUPAC name of N-methyl-1-(2-phenylcyclohexyl)pyrrolidin-3-amine (CID 105402237) is N-methyl-1-(2-phenylcyclohexyl)pyrrolidin-3-amine.
What is the SMILES notation for N-methyl-1-(2-phenylcyclohexyl)pyrrolidin-3-amine?
The canonical SMILES for N-methyl-1-(2-phenylcyclohexyl)pyrrolidin-3-amine is CNC1CCN(C2CCCCC2c2ccccc2)C1.
What is the InChIKey of N-methyl-1-(2-phenylcyclohexyl)pyrrolidin-3-amine?
The InChIKey is QOYNTBCXODSFQH-UHFFFAOYSA-N. The full InChI is InChI=1S/C17H26N2/c1-18-15-11-12-19(13-15)17-10-6-5-9-16(17)14-7-3-2-4-8-14/h2-4,7-8,15-18H,5-6,9-13H2,1H3.
What are the key properties of N-methyl-1-(2-phenylcyclohexyl)pyrrolidin-3-amine?
N-methyl-1-(2-phenylcyclohexyl)pyrrolidin-3-amine has a molecular weight of 258.41 g/mol, XLogP of 3.01, 3 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N-methyl-1-(2-phenylcyclohexyl)pyrrolidin-3-amine is sourced from PubChem (CID 105402237), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).