2-propyl-N-[(2-pyrrolidin-1-ylphenyl)methyl]cyclopropan-1-amine

C17H26N2 — CID 103711490

IUPAC2-propyl-N-[(2-pyrrolidin-1-ylphenyl)methyl]cyclopropan-1-amine
SMILESCCCC1CC1NCc1ccccc1N1CCCC1
InChIInChI=1S/C17H26N2/c1-2-7-14-12-16(14)18-13-15-8-3-4-9-17(15)19-10-5-6-11-19/h3-4,8-9,14,16,18H,2,5-7,10-13H2,1H3
InChIKeyMDIDXUNYAKJNMX-UHFFFAOYSA-N
MW258.41 g/mol
LogP3.57
Rot. Bonds6

About 2-propyl-N-[(2-pyrrolidin-1-ylphenyl)methyl]cyclopropan-1-amine

2-propyl-N-[(2-pyrrolidin-1-ylphenyl)methyl]cyclopropan-1-amine (PubChem CID 103711490) has the molecular formula C17H26N2 and a molecular weight of 258.41 g/mol. Its IUPAC name is 2-propyl-N-[(2-pyrrolidin-1-ylphenyl)methyl]cyclopropan-1-amine.

Molecular Properties

Compound Name2-propyl-N-[(2-pyrrolidin-1-ylphenyl)methyl]cyclopropan-1-amine
PubChem CID103711490
Molecular FormulaC17H26N2
Molecular Weight258.41 g/mol
Exact Mass258.21
IUPAC Name2-propyl-N-[(2-pyrrolidin-1-ylphenyl)methyl]cyclopropan-1-amine
SMILESCCCC1CC1NCc1ccccc1N1CCCC1
InChIInChI=1S/C17H26N2/c1-2-7-14-12-16(14)18-13-15-8-3-4-9-17(15)19-10-5-6-11-19/h3-4,8-9,14,16,18H,2,5-7,10-13H2,1H3
InChIKeyMDIDXUNYAKJNMX-UHFFFAOYSA-N
XLogP3.57
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 ≤ 53.57
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Related Compounds

N-[(2-methoxyphenyl)methyl]-2-propylcyclopropan-1-amine
CID 103711434
N-[(2-nitrophenyl)methyl]-2-propylcyclopropan-1-amine
CID 103711632
1-[2-(2,2-dimethylpropyl)phenyl]pyrrolidine
CID 129255508
2-methyl-N-[(2-pyrrolidin-1-ylphenyl)methyl]pentan-2-amine
CID 115621683
N-[[2-(azepan-1-yl)phenyl]methyl]propan-2-amine
CID 43280522
N-[(2-piperidin-1-ylphenyl)methyl]propan-2-amine
CID 43213770
2-chloro-N-[(2-piperidin-1-ylphenyl)methyl]aniline
CID 102141115
N-[(2-pyrrolidin-1-ylphenyl)methyl]hexan-3-amine
CID 62117804
1,3-dimethyl-5-[[(2-propylcyclopropyl)amino]methyl]pyrimidine-2,4-dione
CID 103711534
N-[(2-pyrrolidin-1-ylphenyl)methyl]heptan-2-amine
CID 43220661
N-[(4-methylphenyl)methyl]-2-propylcyclopropan-1-amine
CID 103711454
azane;1-(2-butylphenyl)piperidine
CID 70222464

Frequently Asked Questions

What is the IUPAC name of 2-propyl-N-[(2-pyrrolidin-1-ylphenyl)methyl]cyclopropan-1-amine?
The IUPAC name of 2-propyl-N-[(2-pyrrolidin-1-ylphenyl)methyl]cyclopropan-1-amine (CID 103711490) is 2-propyl-N-[(2-pyrrolidin-1-ylphenyl)methyl]cyclopropan-1-amine.
What is the SMILES notation for 2-propyl-N-[(2-pyrrolidin-1-ylphenyl)methyl]cyclopropan-1-amine?
The canonical SMILES for 2-propyl-N-[(2-pyrrolidin-1-ylphenyl)methyl]cyclopropan-1-amine is CCCC1CC1NCc1ccccc1N1CCCC1.
What is the InChIKey of 2-propyl-N-[(2-pyrrolidin-1-ylphenyl)methyl]cyclopropan-1-amine?
The InChIKey is MDIDXUNYAKJNMX-UHFFFAOYSA-N. The full InChI is InChI=1S/C17H26N2/c1-2-7-14-12-16(14)18-13-15-8-3-4-9-17(15)19-10-5-6-11-19/h3-4,8-9,14,16,18H,2,5-7,10-13H2,1H3.
What are the key properties of 2-propyl-N-[(2-pyrrolidin-1-ylphenyl)methyl]cyclopropan-1-amine?
2-propyl-N-[(2-pyrrolidin-1-ylphenyl)methyl]cyclopropan-1-amine has a molecular weight of 258.41 g/mol, XLogP of 3.57, 6 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 2-propyl-N-[(2-pyrrolidin-1-ylphenyl)methyl]cyclopropan-1-amine is sourced from PubChem (CID 103711490), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).