N-methyl-N-(pyrrolidin-3-ylmethyl)propan-1-amine

C9H20N2 — CID 54596082

IUPACN-methyl-N-(pyrrolidin-3-ylmethyl)propan-1-amine
SMILESCCCN(C)CC1CCNC1
InChIInChI=1S/C9H20N2/c1-3-6-11(2)8-9-4-5-10-7-9/h9-10H,3-8H2,1-2H3
InChIKeyRPARNKXIGXQZRG-UHFFFAOYSA-N
MW156.27 g/mol
LogP0.94
Rot. Bonds4

About N-methyl-N-(pyrrolidin-3-ylmethyl)propan-1-amine

N-methyl-N-(pyrrolidin-3-ylmethyl)propan-1-amine (PubChem CID 54596082) has the molecular formula C9H20N2 and a molecular weight of 156.27 g/mol. Its IUPAC name is N-methyl-N-(pyrrolidin-3-ylmethyl)propan-1-amine.

Molecular Properties

Compound NameN-methyl-N-(pyrrolidin-3-ylmethyl)propan-1-amine
PubChem CID54596082
Molecular FormulaC9H20N2
Molecular Weight156.27 g/mol
Exact Mass156.16
IUPAC NameN-methyl-N-(pyrrolidin-3-ylmethyl)propan-1-amine
SMILESCCCN(C)CC1CCNC1
InChIInChI=1S/C9H20N2/c1-3-6-11(2)8-9-4-5-10-7-9/h9-10H,3-8H2,1-2H3
InChIKeyRPARNKXIGXQZRG-UHFFFAOYSA-N
XLogP0.94
TPSA15.27 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds4
Heavy Atoms11
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500156.27
LogP ≤ 50.94
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Related Compounds

2-methoxy-N-methyl-N-(pyrrolidin-3-ylmethyl)ethanamine
CID 62371781
N-methyl-2-propan-2-yloxy-N-(pyrrolidin-3-ylmethyl)ethanamine
CID 81055965
3,3-difluoro-N-methyl-N-(pyrrolidin-3-ylmethyl)butan-1-amine
CID 84674397
1-cyclobutyl-N-methyl-N-(pyrrolidin-3-ylmethyl)methanamine
CID 62860068
N,4-dimethyl-N-(pyrrolidin-3-ylmethyl)pentan-1-amine
CID 115209057
N-methyl-N-(piperidin-3-ylmethyl)octan-1-amine
CID 106623723
N,N-dimethyl-1-pyrrolidin-3-ylmethanamine;dihydrochloride
CID 23145859
(Z)-N-methyl-N-(pyrrolidin-3-ylmethyl)but-2-en-1-amine
CID 143248520
N-(cyclopentylmethyl)-N-methylpropan-1-amine
CID 67817061
2-(2-fluorophenyl)-N-methyl-N-(pyrrolidin-3-ylmethyl)ethanamine
CID 115209099
N-benzyl-N-methyl-1-pyrrolidin-3-ylmethanamine
CID 56831736
N-[(4-fluorophenyl)methyl]-N-methyl-1-pyrrolidin-3-ylmethanamine
CID 19358411

Frequently Asked Questions

What is the IUPAC name of N-methyl-N-(pyrrolidin-3-ylmethyl)propan-1-amine?
The IUPAC name of N-methyl-N-(pyrrolidin-3-ylmethyl)propan-1-amine (CID 54596082) is N-methyl-N-(pyrrolidin-3-ylmethyl)propan-1-amine.
What is the SMILES notation for N-methyl-N-(pyrrolidin-3-ylmethyl)propan-1-amine?
The canonical SMILES for N-methyl-N-(pyrrolidin-3-ylmethyl)propan-1-amine is CCCN(C)CC1CCNC1.
What is the InChIKey of N-methyl-N-(pyrrolidin-3-ylmethyl)propan-1-amine?
The InChIKey is RPARNKXIGXQZRG-UHFFFAOYSA-N. The full InChI is InChI=1S/C9H20N2/c1-3-6-11(2)8-9-4-5-10-7-9/h9-10H,3-8H2,1-2H3.
What are the key properties of N-methyl-N-(pyrrolidin-3-ylmethyl)propan-1-amine?
N-methyl-N-(pyrrolidin-3-ylmethyl)propan-1-amine has a molecular weight of 156.27 g/mol, XLogP of 0.94, 4 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N-methyl-N-(pyrrolidin-3-ylmethyl)propan-1-amine is sourced from PubChem (CID 54596082), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).