1-benzyl-N-(2-cyclopropylpropyl)pyrrolidin-3-amine

C17H26N2 — CID 115662847

IUPAC1-benzyl-N-(2-cyclopropylpropyl)pyrrolidin-3-amine
SMILESCC(CNC1CCN(Cc2ccccc2)C1)C1CC1
InChIInChI=1S/C17H26N2/c1-14(16-7-8-16)11-18-17-9-10-19(13-17)12-15-5-3-2-4-6-15/h2-6,14,16-18H,7-13H2,1H3
InChIKeySZCCKHMNAYFEAD-UHFFFAOYSA-N
MW258.41 g/mol
LogP2.90
Rot. Bonds6

About 1-benzyl-N-(2-cyclopropylpropyl)pyrrolidin-3-amine

1-benzyl-N-(2-cyclopropylpropyl)pyrrolidin-3-amine (PubChem CID 115662847) has the molecular formula C17H26N2 and a molecular weight of 258.41 g/mol. Its IUPAC name is 1-benzyl-N-(2-cyclopropylpropyl)pyrrolidin-3-amine.

Molecular Properties

Compound Name1-benzyl-N-(2-cyclopropylpropyl)pyrrolidin-3-amine
PubChem CID115662847
Molecular FormulaC17H26N2
Molecular Weight258.41 g/mol
Exact Mass258.21
IUPAC Name1-benzyl-N-(2-cyclopropylpropyl)pyrrolidin-3-amine
SMILESCC(CNC1CCN(Cc2ccccc2)C1)C1CC1
InChIInChI=1S/C17H26N2/c1-14(16-7-8-16)11-18-17-9-10-19(13-17)12-15-5-3-2-4-6-15/h2-6,14,16-18H,7-13H2,1H3
InChIKeySZCCKHMNAYFEAD-UHFFFAOYSA-N
XLogP2.90
TPSA15.27 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds6
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500258.41
LogP ≤ 52.90
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Related Compounds

3-[(1-benzylpiperidin-3-yl)amino]-2-methylpropan-1-ol
CID 65032022
1-benzyl-N-(2-methylsulfanylpropyl)piperidin-3-amine
CID 115895502
2-[(1-benzylpiperidin-4-yl)amino]-1-cyclopropylethanol
CID 63294565
1-benzyl-N-[(2S)-2-phenylpropyl]piperidin-4-amine
CID 1378352
1-benzyl-N-(2-methyl-3-methylsulfanylpropyl)piperidin-3-amine
CID 63983866
N-(1-benzylpyrrolidin-3-yl)-N',N'-dimethylethane-1,2-diamine
CID 43089230
1-benzyl-N-(2-methylsulfanylethyl)pyrrolidin-3-amine
CID 60694335
(3R)-1-benzyl-N-(trifluoromethyl)pyrrolidin-3-amine
CID 71648802
1-benzyl-N-(2-methylsulfinylpropyl)piperidin-3-amine
CID 115896173
1-benzyl-N-pentan-3-ylpyrrolidin-3-amine
CID 43150638
1-benzyl-N-(1-methylcyclopropyl)pyrrolidin-3-amine
CID 162433803
1-benzyl-N-(cyclobutylmethyl)pyrrolidin-3-amine
CID 43298230

Frequently Asked Questions

What is the IUPAC name of 1-benzyl-N-(2-cyclopropylpropyl)pyrrolidin-3-amine?
The IUPAC name of 1-benzyl-N-(2-cyclopropylpropyl)pyrrolidin-3-amine (CID 115662847) is 1-benzyl-N-(2-cyclopropylpropyl)pyrrolidin-3-amine.
What is the SMILES notation for 1-benzyl-N-(2-cyclopropylpropyl)pyrrolidin-3-amine?
The canonical SMILES for 1-benzyl-N-(2-cyclopropylpropyl)pyrrolidin-3-amine is CC(CNC1CCN(Cc2ccccc2)C1)C1CC1.
What is the InChIKey of 1-benzyl-N-(2-cyclopropylpropyl)pyrrolidin-3-amine?
The InChIKey is SZCCKHMNAYFEAD-UHFFFAOYSA-N. The full InChI is InChI=1S/C17H26N2/c1-14(16-7-8-16)11-18-17-9-10-19(13-17)12-15-5-3-2-4-6-15/h2-6,14,16-18H,7-13H2,1H3.
What are the key properties of 1-benzyl-N-(2-cyclopropylpropyl)pyrrolidin-3-amine?
1-benzyl-N-(2-cyclopropylpropyl)pyrrolidin-3-amine has a molecular weight of 258.41 g/mol, XLogP of 2.90, 6 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 1-benzyl-N-(2-cyclopropylpropyl)pyrrolidin-3-amine is sourced from PubChem (CID 115662847), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).