2-methyl-N-[[2-(4-methylpiperazin-1-yl)-4-pyridinyl]methyl]propan-1-amine

C15H26N4 — CID 60776851

IUPAC2-methyl-N-[[2-(4-methylpiperazin-1-yl)-4-pyridinyl]methyl]propan-1-amine
SMILESCC(C)CNCc1ccnc(N2CCN(C)CC2)c1
InChIInChI=1S/C15H26N4/c1-13(2)11-16-12-14-4-5-17-15(10-14)19-8-6-18(3)7-9-19/h4-5,10,13,16H,6-9,11-12H2,1-3H3
InChIKeyUOADGUSJFPDWEI-UHFFFAOYSA-N
MW262.40 g/mol
LogP1.58
Rot. Bonds5

About 2-methyl-N-[[2-(4-methylpiperazin-1-yl)-4-pyridinyl]methyl]propan-1-amine

2-methyl-N-[[2-(4-methylpiperazin-1-yl)-4-pyridinyl]methyl]propan-1-amine (PubChem CID 60776851) has the molecular formula C15H26N4 and a molecular weight of 262.40 g/mol. Its IUPAC name is 2-methyl-N-[[2-(4-methylpiperazin-1-yl)-4-pyridinyl]methyl]propan-1-amine.

Molecular Properties

Compound Name2-methyl-N-[[2-(4-methylpiperazin-1-yl)-4-pyridinyl]methyl]propan-1-amine
PubChem CID60776851
Molecular FormulaC15H26N4
Molecular Weight262.40 g/mol
Exact Mass262.22
IUPAC Name2-methyl-N-[[2-(4-methylpiperazin-1-yl)-4-pyridinyl]methyl]propan-1-amine
SMILESCC(C)CNCc1ccnc(N2CCN(C)CC2)c1
InChIInChI=1S/C15H26N4/c1-13(2)11-16-12-14-4-5-17-15(10-14)19-8-6-18(3)7-9-19/h4-5,10,13,16H,6-9,11-12H2,1-3H3
InChIKeyUOADGUSJFPDWEI-UHFFFAOYSA-N
XLogP1.58
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 ≤ 51.58
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Related Compounds

N-[[2-(3-methoxypyrrolidin-1-yl)-4-pyridinyl]methyl]-2-methylpropan-1-amine
CID 103539400
(2R)-2-amino-N-[[2-(4-methylpiperazin-1-yl)-4-pyridinyl]methyl]propanamide
CID 119901488
4-methyl-N-[[2-(4-methylpiperazin-1-yl)-4-pyridinyl]methyl]piperazine-1-carboxamide
CID 155944201
2-methyl-N-[[2-(4-methyl-1,4-diazepan-1-yl)-4-pyridinyl]methyl]propan-2-amine
CID 62279824
1-methyl-4-(4-propyl-2-pyridinyl)piperazine
CID 145392081
(E)-2-methyl-N-[[2-(4-methylpiperazin-1-yl)-4-pyridinyl]methyl]-3-phenylprop-2-en-1-amine
CID 119108088
1-[(2R)-1-methoxypropan-2-yl]-1-methyl-3-[[2-(4-methylpiperazin-1-yl)-4-pyridinyl]methyl]urea
CID 94178037
N-[[3-ethoxy-4-(4-methylpiperazin-1-yl)phenyl]methyl]-2-methylpropan-1-amine
CID 84749252
2-[[2-(4-methylpiperazin-1-yl)-4-pyridinyl]methyl]-1-propan-2-ylguanidine
CID 111049026
1-amino-N-[[2-(4-methylpiperazin-1-yl)-4-pyridinyl]methyl]cyclopropane-1-carboxamide
CID 119901458
N-[(2-pyrrolidin-1-yl-4-pyridinyl)methyl]propan-1-amine
CID 62285745
methyl 2-[2-(4-methylpiperazin-1-yl)-4-pyridinyl]acetate
CID 67382772

Frequently Asked Questions

What is the IUPAC name of 2-methyl-N-[[2-(4-methylpiperazin-1-yl)-4-pyridinyl]methyl]propan-1-amine?
The IUPAC name of 2-methyl-N-[[2-(4-methylpiperazin-1-yl)-4-pyridinyl]methyl]propan-1-amine (CID 60776851) is 2-methyl-N-[[2-(4-methylpiperazin-1-yl)-4-pyridinyl]methyl]propan-1-amine.
What is the SMILES notation for 2-methyl-N-[[2-(4-methylpiperazin-1-yl)-4-pyridinyl]methyl]propan-1-amine?
The canonical SMILES for 2-methyl-N-[[2-(4-methylpiperazin-1-yl)-4-pyridinyl]methyl]propan-1-amine is CC(C)CNCc1ccnc(N2CCN(C)CC2)c1.
What is the InChIKey of 2-methyl-N-[[2-(4-methylpiperazin-1-yl)-4-pyridinyl]methyl]propan-1-amine?
The InChIKey is UOADGUSJFPDWEI-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H26N4/c1-13(2)11-16-12-14-4-5-17-15(10-14)19-8-6-18(3)7-9-19/h4-5,10,13,16H,6-9,11-12H2,1-3H3.
What are the key properties of 2-methyl-N-[[2-(4-methylpiperazin-1-yl)-4-pyridinyl]methyl]propan-1-amine?
2-methyl-N-[[2-(4-methylpiperazin-1-yl)-4-pyridinyl]methyl]propan-1-amine has a molecular weight of 262.40 g/mol, XLogP of 1.58, 5 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 2-methyl-N-[[2-(4-methylpiperazin-1-yl)-4-pyridinyl]methyl]propan-1-amine is sourced from PubChem (CID 60776851), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).