1-benzyl-N-(1-methylcyclopropyl)pyrrolidin-3-amine

C15H22N2 — CID 162433803

IUPAC1-benzyl-N-(1-methylcyclopropyl)pyrrolidin-3-amine
SMILESCC1(NC2CCN(Cc3ccccc3)C2)CC1
InChIInChI=1S/C15H22N2/c1-15(8-9-15)16-14-7-10-17(12-14)11-13-5-3-2-4-6-13/h2-6,14,16H,7-12H2,1H3
InChIKeyBJVYIQDPNNZXDM-UHFFFAOYSA-N
MW230.35 g/mol
LogP2.40
Rot. Bonds4

About 1-benzyl-N-(1-methylcyclopropyl)pyrrolidin-3-amine

1-benzyl-N-(1-methylcyclopropyl)pyrrolidin-3-amine (PubChem CID 162433803) has the molecular formula C15H22N2 and a molecular weight of 230.35 g/mol. Its IUPAC name is 1-benzyl-N-(1-methylcyclopropyl)pyrrolidin-3-amine.

Molecular Properties

Compound Name1-benzyl-N-(1-methylcyclopropyl)pyrrolidin-3-amine
PubChem CID162433803
Molecular FormulaC15H22N2
Molecular Weight230.35 g/mol
Exact Mass230.18
IUPAC Name1-benzyl-N-(1-methylcyclopropyl)pyrrolidin-3-amine
SMILESCC1(NC2CCN(Cc3ccccc3)C2)CC1
InChIInChI=1S/C15H22N2/c1-15(8-9-15)16-14-7-10-17(12-14)11-13-5-3-2-4-6-13/h2-6,14,16H,7-12H2,1H3
InChIKeyBJVYIQDPNNZXDM-UHFFFAOYSA-N
XLogP2.40
TPSA15.27 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds4
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500230.35
LogP ≤ 52.40
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Related Compounds

1-benzyl-N-(1-bicyclo[1.1.1]pentanyl)pyrrolidin-3-amine
CID 167503574
1-(1-benzylpyrrolidin-3-yl)-N,4-dimethylpiperidin-4-amine
CID 115303946
1-benzyl-N-[(4-methyloxan-4-yl)methyl]pyrrolidin-3-amine
CID 103748644
N-(1-benzylpyrrolidin-3-yl)-1-ethylpiperidin-4-amine
CID 43223634
1-benzyl-N-[(1-methylcyclopentyl)methyl]piperidin-4-amine
CID 63821124
1-benzyl-N-(2-cyclopropylpropyl)pyrrolidin-3-amine
CID 115662847
1-benzyl-N-[(1-ethylcyclobutyl)methyl]pyrrolidin-3-amine
CID 103748632
1-benzyl-N-methylpiperidin-4-amine
CID 4136128
(3R)-1-benzyl-N-(trifluoromethyl)pyrrolidin-3-amine
CID 71648802
1-benzyl-N-pentan-3-ylpyrrolidin-3-amine
CID 43150638
1-benzyl-N-(4-methylcyclohexyl)pyrrolidin-3-amine
CID 43085353
1-benzyl-N-[(1-methylcyclopropyl)methyl]piperidin-4-amine
CID 103724488

Frequently Asked Questions

What is the IUPAC name of 1-benzyl-N-(1-methylcyclopropyl)pyrrolidin-3-amine?
The IUPAC name of 1-benzyl-N-(1-methylcyclopropyl)pyrrolidin-3-amine (CID 162433803) is 1-benzyl-N-(1-methylcyclopropyl)pyrrolidin-3-amine.
What is the SMILES notation for 1-benzyl-N-(1-methylcyclopropyl)pyrrolidin-3-amine?
The canonical SMILES for 1-benzyl-N-(1-methylcyclopropyl)pyrrolidin-3-amine is CC1(NC2CCN(Cc3ccccc3)C2)CC1.
What is the InChIKey of 1-benzyl-N-(1-methylcyclopropyl)pyrrolidin-3-amine?
The InChIKey is BJVYIQDPNNZXDM-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H22N2/c1-15(8-9-15)16-14-7-10-17(12-14)11-13-5-3-2-4-6-13/h2-6,14,16H,7-12H2,1H3.
What are the key properties of 1-benzyl-N-(1-methylcyclopropyl)pyrrolidin-3-amine?
1-benzyl-N-(1-methylcyclopropyl)pyrrolidin-3-amine has a molecular weight of 230.35 g/mol, XLogP of 2.40, 4 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 1-benzyl-N-(1-methylcyclopropyl)pyrrolidin-3-amine is sourced from PubChem (CID 162433803), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).