N-methyl-N-(3-piperazin-1-ylpropyl)pyridin-2-amine

C13H22N4 — CID 115230516

IUPACN-methyl-N-(3-piperazin-1-ylpropyl)pyridin-2-amine
SMILESCN(CCCN1CCNCC1)c1ccccn1
InChIInChI=1S/C13H22N4/c1-16(13-5-2-3-6-15-13)9-4-10-17-11-7-14-8-12-17/h2-3,5-6,14H,4,7-12H2,1H3
InChIKeyATSLPWOVBVBTLX-UHFFFAOYSA-N
MW234.35 g/mol
LogP0.81
Rot. Bonds5

About N-methyl-N-(3-piperazin-1-ylpropyl)pyridin-2-amine

N-methyl-N-(3-piperazin-1-ylpropyl)pyridin-2-amine (PubChem CID 115230516) has the molecular formula C13H22N4 and a molecular weight of 234.35 g/mol. Its IUPAC name is N-methyl-N-(3-piperazin-1-ylpropyl)pyridin-2-amine.

Molecular Properties

Compound NameN-methyl-N-(3-piperazin-1-ylpropyl)pyridin-2-amine
PubChem CID115230516
Molecular FormulaC13H22N4
Molecular Weight234.35 g/mol
Exact Mass234.18
IUPAC NameN-methyl-N-(3-piperazin-1-ylpropyl)pyridin-2-amine
SMILESCN(CCCN1CCNCC1)c1ccccn1
InChIInChI=1S/C13H22N4/c1-16(13-5-2-3-6-15-13)9-4-10-17-11-7-14-8-12-17/h2-3,5-6,14H,4,7-12H2,1H3
InChIKeyATSLPWOVBVBTLX-UHFFFAOYSA-N
XLogP0.81
TPSA31.40 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds5
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500234.35
LogP ≤ 50.81
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Related Compounds

N-(2,2-dimethyl-3-piperazin-1-ylpropyl)-N-methylpyridin-2-amine
CID 115255272
N-methyl-N-(3-piperazin-1-ylpropyl)pyridin-4-amine
CID 115230518
N-methyl-N-(2-piperazin-1-ylethyl)pyrimidin-4-amine
CID 63266299
N-methyl-2-piperazin-1-yl-N-(pyridin-2-ylmethyl)ethanamine
CID 54945083
N-methyl-N-(4-piperazin-1-ylbutyl)pyridin-3-amine
CID 115240359
3-[methyl(pyridin-2-yl)amino]propan-1-ol
CID 57466357
N-methyl-N-(3-morpholin-4-ylpropyl)-6-piperazin-1-ylpyridin-2-amine
CID 68559270
N-methyl-N-(3-morpholin-4-ylpropyl)-5-piperazin-1-ylpyridin-2-amine
CID 68513308
N-methyl-N-(2-piperazin-1-ylethyl)quinolin-2-amine
CID 63266429
4-[methyl(pyridin-2-yl)amino]butan-1-ol
CID 115217548
N'-methyl-N'-pyridin-2-ylpropane-1,3-diamine;dihydrochloride
CID 134690924
4-[methyl(pyridin-2-yl)amino]butanenitrile
CID 115231630

Frequently Asked Questions

What is the IUPAC name of N-methyl-N-(3-piperazin-1-ylpropyl)pyridin-2-amine?
The IUPAC name of N-methyl-N-(3-piperazin-1-ylpropyl)pyridin-2-amine (CID 115230516) is N-methyl-N-(3-piperazin-1-ylpropyl)pyridin-2-amine.
What is the SMILES notation for N-methyl-N-(3-piperazin-1-ylpropyl)pyridin-2-amine?
The canonical SMILES for N-methyl-N-(3-piperazin-1-ylpropyl)pyridin-2-amine is CN(CCCN1CCNCC1)c1ccccn1.
What is the InChIKey of N-methyl-N-(3-piperazin-1-ylpropyl)pyridin-2-amine?
The InChIKey is ATSLPWOVBVBTLX-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H22N4/c1-16(13-5-2-3-6-15-13)9-4-10-17-11-7-14-8-12-17/h2-3,5-6,14H,4,7-12H2,1H3.
What are the key properties of N-methyl-N-(3-piperazin-1-ylpropyl)pyridin-2-amine?
N-methyl-N-(3-piperazin-1-ylpropyl)pyridin-2-amine has a molecular weight of 234.35 g/mol, XLogP of 0.81, 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-ylpropyl)pyridin-2-amine is sourced from PubChem (CID 115230516), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).