N-[3-methyl-2-(4-methylpiperazin-1-yl)butyl]pyridin-4-amine

C15H26N4 — CID 61241411

IUPACN-[3-methyl-2-(4-methylpiperazin-1-yl)butyl]pyridin-4-amine
SMILESCC(C)C(CNc1ccncc1)N1CCN(C)CC1
InChIInChI=1S/C15H26N4/c1-13(2)15(19-10-8-18(3)9-11-19)12-17-14-4-6-16-7-5-14/h4-7,13,15H,8-12H2,1-3H3,(H,16,17)
InChIKeyHEAUFZNLISRNFA-UHFFFAOYSA-N
MW262.40 g/mol
LogP1.77
Rot. Bonds5

About N-[3-methyl-2-(4-methylpiperazin-1-yl)butyl]pyridin-4-amine

N-[3-methyl-2-(4-methylpiperazin-1-yl)butyl]pyridin-4-amine (PubChem CID 61241411) has the molecular formula C15H26N4 and a molecular weight of 262.40 g/mol. Its IUPAC name is N-[3-methyl-2-(4-methylpiperazin-1-yl)butyl]pyridin-4-amine.

Molecular Properties

Compound NameN-[3-methyl-2-(4-methylpiperazin-1-yl)butyl]pyridin-4-amine
PubChem CID61241411
Molecular FormulaC15H26N4
Molecular Weight262.40 g/mol
Exact Mass262.22
IUPAC NameN-[3-methyl-2-(4-methylpiperazin-1-yl)butyl]pyridin-4-amine
SMILESCC(C)C(CNc1ccncc1)N1CCN(C)CC1
InChIInChI=1S/C15H26N4/c1-13(2)15(19-10-8-18(3)9-11-19)12-17-14-4-6-16-7-5-14/h4-7,13,15H,8-12H2,1-3H3,(H,16,17)
InChIKeyHEAUFZNLISRNFA-UHFFFAOYSA-N
XLogP1.77
TPSA31.40 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds5
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500262.40
LogP ≤ 51.77
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Related Compounds

N-[3-methyl-2-(4-methylpiperazin-1-yl)butyl]pyrimidin-4-amine
CID 61253596
1-[(2S)-3-methyl-2-(4-methylpiperazin-1-yl)butyl]-3-(pyridin-4-ylmethyl)urea
CID 95570484
1-[3-methyl-2-(4-methylpiperazin-1-yl)butyl]-3-(pyridin-4-ylmethyl)urea
CID 56813976
2-N-[3-methyl-2-(4-methylpiperazin-1-yl)butyl]pyrazine-2,5-diamine
CID 80653824
4,6-dimethyl-N-[3-methyl-2-(4-methylpiperazin-1-yl)butyl]pyrimidin-2-amine
CID 60732106
6-chloro-N-[3-methyl-2-(4-methylpiperazin-1-yl)butyl]pyridazin-3-amine
CID 61241021
5-methyl-N-[3-methyl-2-(4-methylpiperazin-1-yl)butyl]pyridin-2-amine
CID 61241218
3,6-dimethyl-N-[3-methyl-2-(4-methylpiperazin-1-yl)butyl]pyrazin-2-amine
CID 65416239
N-[3-methyl-2-(4-methylpiperazin-1-yl)butyl]-4-phenyl-1,3-thiazol-2-amine
CID 133371007
3-cyclopropyl-N-[3-methyl-2-(4-methylpiperazin-1-yl)butyl]-1,2,4-thiadiazol-5-amine
CID 65276766
3-methyl-N-[(1-methylimidazol-2-yl)methyl]-2-(4-methylpiperazin-1-yl)butan-1-amine
CID 62350137
2-chloro-5-fluoro-N-[3-methyl-2-(4-methylpiperazin-1-yl)butyl]pyrimidin-4-amine
CID 106194210

Frequently Asked Questions

What is the IUPAC name of N-[3-methyl-2-(4-methylpiperazin-1-yl)butyl]pyridin-4-amine?
The IUPAC name of N-[3-methyl-2-(4-methylpiperazin-1-yl)butyl]pyridin-4-amine (CID 61241411) is N-[3-methyl-2-(4-methylpiperazin-1-yl)butyl]pyridin-4-amine.
What is the SMILES notation for N-[3-methyl-2-(4-methylpiperazin-1-yl)butyl]pyridin-4-amine?
The canonical SMILES for N-[3-methyl-2-(4-methylpiperazin-1-yl)butyl]pyridin-4-amine is CC(C)C(CNc1ccncc1)N1CCN(C)CC1.
What is the InChIKey of N-[3-methyl-2-(4-methylpiperazin-1-yl)butyl]pyridin-4-amine?
The InChIKey is HEAUFZNLISRNFA-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H26N4/c1-13(2)15(19-10-8-18(3)9-11-19)12-17-14-4-6-16-7-5-14/h4-7,13,15H,8-12H2,1-3H3,(H,16,17).
What are the key properties of N-[3-methyl-2-(4-methylpiperazin-1-yl)butyl]pyridin-4-amine?
N-[3-methyl-2-(4-methylpiperazin-1-yl)butyl]pyridin-4-amine has a molecular weight of 262.40 g/mol, XLogP of 1.77, 5 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-[3-methyl-2-(4-methylpiperazin-1-yl)butyl]pyridin-4-amine is sourced from PubChem (CID 61241411), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).