2-methyl-2-phenyl-N-propan-2-yl-3-pyrrolidin-1-ylpropan-1-amine

C17H28N2 — CID 62262976

IUPAC2-methyl-2-phenyl-N-propan-2-yl-3-pyrrolidin-1-ylpropan-1-amine
SMILESCC(C)NCC(C)(CN1CCCC1)c1ccccc1
InChIInChI=1S/C17H28N2/c1-15(2)18-13-17(3,14-19-11-7-8-12-19)16-9-5-4-6-10-16/h4-6,9-10,15,18H,7-8,11-14H2,1-3H3
InChIKeyPWRAISPGMLMHEI-UHFFFAOYSA-N
MW260.43 g/mol
LogP3.04
Rot. Bonds6

About 2-methyl-2-phenyl-N-propan-2-yl-3-pyrrolidin-1-ylpropan-1-amine

2-methyl-2-phenyl-N-propan-2-yl-3-pyrrolidin-1-ylpropan-1-amine (PubChem CID 62262976) has the molecular formula C17H28N2 and a molecular weight of 260.43 g/mol. Its IUPAC name is 2-methyl-2-phenyl-N-propan-2-yl-3-pyrrolidin-1-ylpropan-1-amine.

Molecular Properties

Compound Name2-methyl-2-phenyl-N-propan-2-yl-3-pyrrolidin-1-ylpropan-1-amine
PubChem CID62262976
Molecular FormulaC17H28N2
Molecular Weight260.43 g/mol
Exact Mass260.23
IUPAC Name2-methyl-2-phenyl-N-propan-2-yl-3-pyrrolidin-1-ylpropan-1-amine
SMILESCC(C)NCC(C)(CN1CCCC1)c1ccccc1
InChIInChI=1S/C17H28N2/c1-15(2)18-13-17(3,14-19-11-7-8-12-19)16-9-5-4-6-10-16/h4-6,9-10,15,18H,7-8,11-14H2,1-3H3
InChIKeyPWRAISPGMLMHEI-UHFFFAOYSA-N
XLogP3.04
TPSA15.27 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds6
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500260.43
LogP ≤ 53.04
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Related Compounds

1-[2-methyl-2-phenyl-3-(propan-2-ylamino)propyl]piperidin-4-ol
CID 62261469
3-(azocan-1-yl)-N-ethyl-2-methyl-2-phenylpropan-1-amine
CID 62262873
N,2-dimethyl-2-phenyl-3-(1,4-thiazepan-4-yl)propan-1-amine
CID 55056359
3-(4,4-dimethylazepan-1-yl)-N,2-dimethyl-2-phenylpropan-1-amine
CID 65282057
N-ethyl-2-methyl-2-phenyl-3-(1,4-thiazepan-4-yl)propan-1-amine
CID 62271130
N,2-dimethyl-2-phenyl-N,N'-di(propan-2-yl)propane-1,3-diamine
CID 62262825
N-cyclopropyl-N,2-dimethyl-2-phenyl-N'-propan-2-ylpropane-1,3-diamine
CID 62262364
2-phenyl-1-(1-pyrrolidin-1-ylpropan-2-ylamino)propan-2-ol
CID 62374500
N-(2,2-dimethylpropyl)-N,2-dimethyl-2-phenyl-N'-propan-2-ylpropane-1,3-diamine
CID 62260878
N,N-dimethyl-1-[2-methyl-3-(methylamino)-2-phenylpropyl]piperidin-4-amine
CID 62257862
2-methyl-2-phenyl-3-(4-propan-2-ylpiperazin-1-yl)propan-1-ol
CID 62271685
2-methyl-2-phenyl-N-propyl-3-thiomorpholin-4-ylpropan-1-amine
CID 62261570

Frequently Asked Questions

What is the IUPAC name of 2-methyl-2-phenyl-N-propan-2-yl-3-pyrrolidin-1-ylpropan-1-amine?
The IUPAC name of 2-methyl-2-phenyl-N-propan-2-yl-3-pyrrolidin-1-ylpropan-1-amine (CID 62262976) is 2-methyl-2-phenyl-N-propan-2-yl-3-pyrrolidin-1-ylpropan-1-amine.
What is the SMILES notation for 2-methyl-2-phenyl-N-propan-2-yl-3-pyrrolidin-1-ylpropan-1-amine?
The canonical SMILES for 2-methyl-2-phenyl-N-propan-2-yl-3-pyrrolidin-1-ylpropan-1-amine is CC(C)NCC(C)(CN1CCCC1)c1ccccc1.
What is the InChIKey of 2-methyl-2-phenyl-N-propan-2-yl-3-pyrrolidin-1-ylpropan-1-amine?
The InChIKey is PWRAISPGMLMHEI-UHFFFAOYSA-N. The full InChI is InChI=1S/C17H28N2/c1-15(2)18-13-17(3,14-19-11-7-8-12-19)16-9-5-4-6-10-16/h4-6,9-10,15,18H,7-8,11-14H2,1-3H3.
What are the key properties of 2-methyl-2-phenyl-N-propan-2-yl-3-pyrrolidin-1-ylpropan-1-amine?
2-methyl-2-phenyl-N-propan-2-yl-3-pyrrolidin-1-ylpropan-1-amine has a molecular weight of 260.43 g/mol, XLogP of 3.04, 6 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 2-methyl-2-phenyl-N-propan-2-yl-3-pyrrolidin-1-ylpropan-1-amine is sourced from PubChem (CID 62262976), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).