N-methyl-N-(3-piperazin-1-ylbutyl)pyridin-3-amine

C14H24N4 — CID 115255466

IUPACN-methyl-N-(3-piperazin-1-ylbutyl)pyridin-3-amine
SMILESCC(CCN(C)c1cccnc1)N1CCNCC1
InChIInChI=1S/C14H24N4/c1-13(18-10-7-15-8-11-18)5-9-17(2)14-4-3-6-16-12-14/h3-4,6,12-13,15H,5,7-11H2,1-2H3
InChIKeyMXQPMJYYSCFLDO-UHFFFAOYSA-N
MW248.37 g/mol
LogP1.20
Rot. Bonds5

About N-methyl-N-(3-piperazin-1-ylbutyl)pyridin-3-amine

N-methyl-N-(3-piperazin-1-ylbutyl)pyridin-3-amine (PubChem CID 115255466) has the molecular formula C14H24N4 and a molecular weight of 248.37 g/mol. Its IUPAC name is N-methyl-N-(3-piperazin-1-ylbutyl)pyridin-3-amine.

Molecular Properties

Compound NameN-methyl-N-(3-piperazin-1-ylbutyl)pyridin-3-amine
PubChem CID115255466
Molecular FormulaC14H24N4
Molecular Weight248.37 g/mol
Exact Mass248.20
IUPAC NameN-methyl-N-(3-piperazin-1-ylbutyl)pyridin-3-amine
SMILESCC(CCN(C)c1cccnc1)N1CCNCC1
InChIInChI=1S/C14H24N4/c1-13(18-10-7-15-8-11-18)5-9-17(2)14-4-3-6-16-12-14/h3-4,6,12-13,15H,5,7-11H2,1-2H3
InChIKeyMXQPMJYYSCFLDO-UHFFFAOYSA-N
XLogP1.20
TPSA31.40 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds5
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500248.37
LogP ≤ 51.20
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Related Compounds

N-methyl-N-(4-piperazin-1-ylbutyl)pyridin-3-amine
CID 115240359
N-methyl-2-piperazin-1-yl-N-(pyridin-3-ylmethyl)propan-1-amine
CID 115255740
N-methyl-N-[2-(4-methylpiperazin-2-yl)ethyl]pyridin-3-amine
CID 115239388
N-methyl-3-piperazin-1-yl-N-(1H-pyrrol-2-ylmethyl)butan-1-amine
CID 115255504
N'-methyl-N-propan-2-yl-N'-pyridin-3-ylethane-1,2-diamine
CID 115206418
1-[(1S)-1-pyridin-3-ylpropyl]piperazine
CID 92764058
1-piperazin-1-yl-1-pyridin-3-ylpropan-2-ol
CID 82286657
1-[(1S)-1-pyridin-3-ylpentyl]piperazine
CID 171308841
N-methyl-N-[2-(2-pyridin-3-ylpiperazin-1-yl)ethyl]aniline
CID 120756006
1-[(2R)-2-pyridin-3-ylpropyl]piperazine
CID 67593511
N,1-dimethyl-N-(3-piperazin-1-ylbutyl)pyrrolidin-3-amine
CID 115255475
N,2-dimethyl-2-piperazin-1-yl-N-pyridin-3-ylpropanamide
CID 80550063

Frequently Asked Questions

What is the IUPAC name of N-methyl-N-(3-piperazin-1-ylbutyl)pyridin-3-amine?
The IUPAC name of N-methyl-N-(3-piperazin-1-ylbutyl)pyridin-3-amine (CID 115255466) is N-methyl-N-(3-piperazin-1-ylbutyl)pyridin-3-amine.
What is the SMILES notation for N-methyl-N-(3-piperazin-1-ylbutyl)pyridin-3-amine?
The canonical SMILES for N-methyl-N-(3-piperazin-1-ylbutyl)pyridin-3-amine is CC(CCN(C)c1cccnc1)N1CCNCC1.
What is the InChIKey of N-methyl-N-(3-piperazin-1-ylbutyl)pyridin-3-amine?
The InChIKey is MXQPMJYYSCFLDO-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H24N4/c1-13(18-10-7-15-8-11-18)5-9-17(2)14-4-3-6-16-12-14/h3-4,6,12-13,15H,5,7-11H2,1-2H3.
What are the key properties of N-methyl-N-(3-piperazin-1-ylbutyl)pyridin-3-amine?
N-methyl-N-(3-piperazin-1-ylbutyl)pyridin-3-amine has a molecular weight of 248.37 g/mol, XLogP of 1.20, 5 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-methyl-N-(3-piperazin-1-ylbutyl)pyridin-3-amine is sourced from PubChem (CID 115255466), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).