N,N-dimethyl-1-pyrrolidin-3-ylmethanamine

C7H16N2 — CID 14086165

IUPACN,N-dimethyl-1-pyrrolidin-3-ylmethanamine
SMILESCN(C)CC1CCNC1
InChIInChI=1S/C7H16N2/c1-9(2)6-7-3-4-8-5-7/h7-8H,3-6H2,1-2H3
InChIKeyDDROADVTQNAKPF-UHFFFAOYSA-N
MW128.22 g/mol
LogP0.16
Rot. Bonds2

About N,N-dimethyl-1-pyrrolidin-3-ylmethanamine

N,N-dimethyl-1-pyrrolidin-3-ylmethanamine (PubChem CID 14086165) has the molecular formula C7H16N2 and a molecular weight of 128.22 g/mol. Its IUPAC name is N,N-dimethyl-1-pyrrolidin-3-ylmethanamine.

Molecular Properties

Compound NameN,N-dimethyl-1-pyrrolidin-3-ylmethanamine
PubChem CID14086165
Molecular FormulaC7H16N2
Molecular Weight128.22 g/mol
Exact Mass128.13
IUPAC NameN,N-dimethyl-1-pyrrolidin-3-ylmethanamine
SMILESCN(C)CC1CCNC1
InChIInChI=1S/C7H16N2/c1-9(2)6-7-3-4-8-5-7/h7-8H,3-6H2,1-2H3
InChIKeyDDROADVTQNAKPF-UHFFFAOYSA-N
XLogP0.16
TPSA15.27 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds2
Heavy Atoms9
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500128.22
LogP ≤ 50.16
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Related Compounds

CID 31670
CID 31670
CID 24275255
CID 24275255
CID 24696719
CID 24696719
CID 17389968
CID 17389968
CID 17389965
CID 17389965
CID 21978903
CID 21978903
CID 24275282
CID 24275282
CID 15028164
CID 15028164
CID 118158
CID 118158
CID 1519366
CID 1519366
CID 12464314
CID 12464314
CID 14075474
CID 14075474

Frequently Asked Questions

What is the IUPAC name of N,N-dimethyl-1-pyrrolidin-3-ylmethanamine?
The IUPAC name of N,N-dimethyl-1-pyrrolidin-3-ylmethanamine (CID 14086165) is N,N-dimethyl-1-pyrrolidin-3-ylmethanamine.
What is the SMILES notation for N,N-dimethyl-1-pyrrolidin-3-ylmethanamine?
The canonical SMILES for N,N-dimethyl-1-pyrrolidin-3-ylmethanamine is CN(C)CC1CCNC1.
What is the InChIKey of N,N-dimethyl-1-pyrrolidin-3-ylmethanamine?
The InChIKey is DDROADVTQNAKPF-UHFFFAOYSA-N. The full InChI is InChI=1S/C7H16N2/c1-9(2)6-7-3-4-8-5-7/h7-8H,3-6H2,1-2H3.
What are the key properties of N,N-dimethyl-1-pyrrolidin-3-ylmethanamine?
N,N-dimethyl-1-pyrrolidin-3-ylmethanamine has a molecular weight of 128.22 g/mol, XLogP of 0.16, 2 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N,N-dimethyl-1-pyrrolidin-3-ylmethanamine is sourced from PubChem (CID 14086165), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).