1-(4-methyl-3-pyridinyl)-N-propylhexan-3-amine

C15H26N2 — CID 66272340

IUPAC1-(4-methyl-3-pyridinyl)-N-propylhexan-3-amine
SMILESCCCNC(CCC)CCc1cnccc1C
InChIInChI=1S/C15H26N2/c1-4-6-15(17-10-5-2)8-7-14-12-16-11-9-13(14)3/h9,11-12,15,17H,4-8,10H2,1-3H3
InChIKeyQNIKHXNRJFOOFV-UHFFFAOYSA-N
MW234.39 g/mol
LogP3.49
Rot. Bonds8

About 1-(4-methyl-3-pyridinyl)-N-propylhexan-3-amine

1-(4-methyl-3-pyridinyl)-N-propylhexan-3-amine (PubChem CID 66272340) has the molecular formula C15H26N2 and a molecular weight of 234.39 g/mol. Its IUPAC name is 1-(4-methyl-3-pyridinyl)-N-propylhexan-3-amine.

Molecular Properties

Compound Name1-(4-methyl-3-pyridinyl)-N-propylhexan-3-amine
PubChem CID66272340
Molecular FormulaC15H26N2
Molecular Weight234.39 g/mol
Exact Mass234.21
IUPAC Name1-(4-methyl-3-pyridinyl)-N-propylhexan-3-amine
SMILESCCCNC(CCC)CCc1cnccc1C
InChIInChI=1S/C15H26N2/c1-4-6-15(17-10-5-2)8-7-14-12-16-11-9-13(14)3/h9,11-12,15,17H,4-8,10H2,1-3H3
InChIKeyQNIKHXNRJFOOFV-UHFFFAOYSA-N
XLogP3.49
TPSA24.92 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds8
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500234.39
LogP ≤ 53.49
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Related Compounds

4-(2-methylphenyl)-N-propyl-1-pyridin-3-ylbutan-2-amine
CID 105180056
1-(2-methoxy-5-methylphenyl)-N-propylhexan-3-amine
CID 62160648
1-cyclopropyl-N-ethyl-3-(4-methyl-3-pyridinyl)propan-1-amine
CID 66272541
N-[2-(2-methylphenyl)ethyl]heptan-4-amine
CID 79762422
1-(2-methylphenyl)-N-propyldecan-3-amine
CID 105125070
N-propyl-1-quinolin-5-ylhexan-3-amine
CID 81221861
N-ethyl-3-(4-methyl-3-pyridinyl)propan-1-amine
CID 66272322
(2S)-2-[3-(4-methyl-3-pyridinyl)propylamino]hexanoic acid
CID 122044749
1-(5-fluoro-2-methylphenyl)-N-propylheptan-4-amine
CID 105375522
N-methyl-3-(4-methyl-3-pyridinyl)propan-1-amine
CID 66272321
4-(2-methylphenyl)-N-propyl-1-(1,3-thiazol-5-yl)butan-2-amine
CID 105178082
1-(5-bromo-2-methoxyphenyl)-N-propylhexan-3-amine
CID 63399896

Frequently Asked Questions

What is the IUPAC name of 1-(4-methyl-3-pyridinyl)-N-propylhexan-3-amine?
The IUPAC name of 1-(4-methyl-3-pyridinyl)-N-propylhexan-3-amine (CID 66272340) is 1-(4-methyl-3-pyridinyl)-N-propylhexan-3-amine.
What is the SMILES notation for 1-(4-methyl-3-pyridinyl)-N-propylhexan-3-amine?
The canonical SMILES for 1-(4-methyl-3-pyridinyl)-N-propylhexan-3-amine is CCCNC(CCC)CCc1cnccc1C.
What is the InChIKey of 1-(4-methyl-3-pyridinyl)-N-propylhexan-3-amine?
The InChIKey is QNIKHXNRJFOOFV-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H26N2/c1-4-6-15(17-10-5-2)8-7-14-12-16-11-9-13(14)3/h9,11-12,15,17H,4-8,10H2,1-3H3.
What are the key properties of 1-(4-methyl-3-pyridinyl)-N-propylhexan-3-amine?
1-(4-methyl-3-pyridinyl)-N-propylhexan-3-amine has a molecular weight of 234.39 g/mol, XLogP of 3.49, 8 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 1-(4-methyl-3-pyridinyl)-N-propylhexan-3-amine is sourced from PubChem (CID 66272340), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).