2,2-dimethyl-1-(2-phenylethyl)pyrrolidin-3-amine

C14H22N2 — CID 117016985

IUPAC2,2-dimethyl-1-(2-phenylethyl)pyrrolidin-3-amine
SMILESCC1(C)C(N)CCN1CCc1ccccc1
InChIInChI=1S/C14H22N2/c1-14(2)13(15)9-11-16(14)10-8-12-6-4-3-5-7-12/h3-7,13H,8-11,15H2,1-2H3
InChIKeyQRDZETFIGIWZAY-UHFFFAOYSA-N
MW218.34 g/mol
LogP2.04
Rot. Bonds3

About 2,2-dimethyl-1-(2-phenylethyl)pyrrolidin-3-amine

2,2-dimethyl-1-(2-phenylethyl)pyrrolidin-3-amine (PubChem CID 117016985) has the molecular formula C14H22N2 and a molecular weight of 218.34 g/mol. Its IUPAC name is 2,2-dimethyl-1-(2-phenylethyl)pyrrolidin-3-amine.

Molecular Properties

Compound Name2,2-dimethyl-1-(2-phenylethyl)pyrrolidin-3-amine
PubChem CID117016985
Molecular FormulaC14H22N2
Molecular Weight218.34 g/mol
Exact Mass218.18
IUPAC Name2,2-dimethyl-1-(2-phenylethyl)pyrrolidin-3-amine
SMILESCC1(C)C(N)CCN1CCc1ccccc1
InChIInChI=1S/C14H22N2/c1-14(2)13(15)9-11-16(14)10-8-12-6-4-3-5-7-12/h3-7,13H,8-11,15H2,1-2H3
InChIKeyQRDZETFIGIWZAY-UHFFFAOYSA-N
XLogP2.04
TPSA29.26 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds3
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500218.34
LogP ≤ 52.04
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Related Compounds

2-[2,2-dimethyl-1-(2-phenylethyl)pyrrolidin-3-yl]ethanamine
CID 117017552
2,2-dimethyl-1-(2-phenylethyl)piperidine-3-carboxylic acid
CID 117019433
6,6-dimethyl-1-(2-phenylethyl)piperidin-3-amine
CID 117020993
(3R)-3-amino-1-(2-phenylethyl)pyrrolidin-2-one
CID 11096743
2-(1-benzyl-2,2-dimethylpyrrolidin-3-yl)acetic acid
CID 83851242
1-(2-phenylethyl)pyrrolidin-3-amine
CID 18411819
2,2-dimethyl-1-(2-phenylethyl)piperidin-3-one
CID 117019112
5,5-dimethyl-4-(2-phenylethyl)piperazin-2-one
CID 117024032
hypochlorous acid;1-(2-phenylethyl)piperidin-4-amine
CID 159010718
1-benzyl-2,2-dimethylpyrrolidin-3-ol
CID 83848241
1-benzyl-3-bromo-2,2-dimethylpyrrolidine
CID 130979463
2-cyclopropyl-2,5-dimethyl-1-(2-phenylethyl)piperazine
CID 64844387

Frequently Asked Questions

What is the IUPAC name of 2,2-dimethyl-1-(2-phenylethyl)pyrrolidin-3-amine?
The IUPAC name of 2,2-dimethyl-1-(2-phenylethyl)pyrrolidin-3-amine (CID 117016985) is 2,2-dimethyl-1-(2-phenylethyl)pyrrolidin-3-amine.
What is the SMILES notation for 2,2-dimethyl-1-(2-phenylethyl)pyrrolidin-3-amine?
The canonical SMILES for 2,2-dimethyl-1-(2-phenylethyl)pyrrolidin-3-amine is CC1(C)C(N)CCN1CCc1ccccc1.
What is the InChIKey of 2,2-dimethyl-1-(2-phenylethyl)pyrrolidin-3-amine?
The InChIKey is QRDZETFIGIWZAY-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H22N2/c1-14(2)13(15)9-11-16(14)10-8-12-6-4-3-5-7-12/h3-7,13H,8-11,15H2,1-2H3.
What are the key properties of 2,2-dimethyl-1-(2-phenylethyl)pyrrolidin-3-amine?
2,2-dimethyl-1-(2-phenylethyl)pyrrolidin-3-amine has a molecular weight of 218.34 g/mol, XLogP of 2.04, 3 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 2,2-dimethyl-1-(2-phenylethyl)pyrrolidin-3-amine is sourced from PubChem (CID 117016985), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).