1-[3-[(cyclopropylamino)methyl]-4-pyridinyl]-N,N-dimethylpyrrolidin-3-amine

C15H24N4 — CID 81247494

IUPAC1-[3-[(cyclopropylamino)methyl]-4-pyridinyl]-N,N-dimethylpyrrolidin-3-amine
SMILESCN(C)C1CCN(c2ccncc2CNC2CC2)C1
InChIInChI=1S/C15H24N4/c1-18(2)14-6-8-19(11-14)15-5-7-16-9-12(15)10-17-13-3-4-13/h5,7,9,13-14,17H,3-4,6,8,10-11H2,1-2H3
InChIKeyNJNYIYDPNYWTAP-UHFFFAOYSA-N
MW260.38 g/mol
LogP1.47
Rot. Bonds5

About 1-[3-[(cyclopropylamino)methyl]-4-pyridinyl]-N,N-dimethylpyrrolidin-3-amine

1-[3-[(cyclopropylamino)methyl]-4-pyridinyl]-N,N-dimethylpyrrolidin-3-amine (PubChem CID 81247494) has the molecular formula C15H24N4 and a molecular weight of 260.38 g/mol. Its IUPAC name is 1-[3-[(cyclopropylamino)methyl]-4-pyridinyl]-N,N-dimethylpyrrolidin-3-amine.

Molecular Properties

Compound Name1-[3-[(cyclopropylamino)methyl]-4-pyridinyl]-N,N-dimethylpyrrolidin-3-amine
PubChem CID81247494
Molecular FormulaC15H24N4
Molecular Weight260.38 g/mol
Exact Mass260.20
IUPAC Name1-[3-[(cyclopropylamino)methyl]-4-pyridinyl]-N,N-dimethylpyrrolidin-3-amine
SMILESCN(C)C1CCN(c2ccncc2CNC2CC2)C1
InChIInChI=1S/C15H24N4/c1-18(2)14-6-8-19(11-14)15-5-7-16-9-12(15)10-17-13-3-4-13/h5,7,9,13-14,17H,3-4,6,8,10-11H2,1-2H3
InChIKeyNJNYIYDPNYWTAP-UHFFFAOYSA-N
XLogP1.47
TPSA31.40 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds5
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500260.38
LogP ≤ 51.47
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Related Compounds

Nornicotine
CID 91462
3-(Pyrrolidin-2-yl)pyridine
CID 412
Rivanicline
CID 5310967
Tc-2216
CID 10176607
(R)-Nornicotine
CID 93047
3-Methyl-4-pyridinamine
CID 74811
1-(4-Pyridyl)piperazine
CID 70517
(S)-nicotinium(1+)
CID 6919000
N-(pyridin-3-ylmethyl)aniline
CID 1082702
4-Pyrrolidinopyridine
CID 75567
Methyl[1-(pyridin-4-yl)ethyl]amine
CID 16776491
4-(Methylamino)pyridine
CID 123098

Frequently Asked Questions

What is the IUPAC name of 1-[3-[(cyclopropylamino)methyl]-4-pyridinyl]-N,N-dimethylpyrrolidin-3-amine?
The IUPAC name of 1-[3-[(cyclopropylamino)methyl]-4-pyridinyl]-N,N-dimethylpyrrolidin-3-amine (CID 81247494) is 1-[3-[(cyclopropylamino)methyl]-4-pyridinyl]-N,N-dimethylpyrrolidin-3-amine.
What is the SMILES notation for 1-[3-[(cyclopropylamino)methyl]-4-pyridinyl]-N,N-dimethylpyrrolidin-3-amine?
The canonical SMILES for 1-[3-[(cyclopropylamino)methyl]-4-pyridinyl]-N,N-dimethylpyrrolidin-3-amine is CN(C)C1CCN(c2ccncc2CNC2CC2)C1.
What is the InChIKey of 1-[3-[(cyclopropylamino)methyl]-4-pyridinyl]-N,N-dimethylpyrrolidin-3-amine?
The InChIKey is NJNYIYDPNYWTAP-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H24N4/c1-18(2)14-6-8-19(11-14)15-5-7-16-9-12(15)10-17-13-3-4-13/h5,7,9,13-14,17H,3-4,6,8,10-11H2,1-2H3.
What are the key properties of 1-[3-[(cyclopropylamino)methyl]-4-pyridinyl]-N,N-dimethylpyrrolidin-3-amine?
1-[3-[(cyclopropylamino)methyl]-4-pyridinyl]-N,N-dimethylpyrrolidin-3-amine has a molecular weight of 260.38 g/mol, XLogP of 1.47, 5 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 1-[3-[(cyclopropylamino)methyl]-4-pyridinyl]-N,N-dimethylpyrrolidin-3-amine is sourced from PubChem (CID 81247494), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).