N,3-dimethyl-2-pyridin-3-ylhexan-1-amine

C13H22N2 — CID 107887227

IUPACN,3-dimethyl-2-pyridin-3-ylhexan-1-amine
SMILESCCCC(C)C(CNC)c1cccnc1
InChIInChI=1S/C13H22N2/c1-4-6-11(2)13(10-14-3)12-7-5-8-15-9-12/h5,7-9,11,13-14H,4,6,10H2,1-3H3
InChIKeySOLGYNSUDUDCHC-UHFFFAOYSA-N
MW206.33 g/mol
LogP2.82
Rot. Bonds6

About N,3-dimethyl-2-pyridin-3-ylhexan-1-amine

N,3-dimethyl-2-pyridin-3-ylhexan-1-amine (PubChem CID 107887227) has the molecular formula C13H22N2 and a molecular weight of 206.33 g/mol. Its IUPAC name is N,3-dimethyl-2-pyridin-3-ylhexan-1-amine.

Molecular Properties

Compound NameN,3-dimethyl-2-pyridin-3-ylhexan-1-amine
PubChem CID107887227
Molecular FormulaC13H22N2
Molecular Weight206.33 g/mol
Exact Mass206.18
IUPAC NameN,3-dimethyl-2-pyridin-3-ylhexan-1-amine
SMILESCCCC(C)C(CNC)c1cccnc1
InChIInChI=1S/C13H22N2/c1-4-6-11(2)13(10-14-3)12-7-5-8-15-9-12/h5,7-9,11,13-14H,4,6,10H2,1-3H3
InChIKeySOLGYNSUDUDCHC-UHFFFAOYSA-N
XLogP2.82
TPSA24.92 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds6
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500206.33
LogP ≤ 52.82
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Related Compounds

2-methyl-1-pyridin-3-ylpentan-1-amine
CID 115799302
2-methyl-N-propyl-1-pyridin-3-ylpentan-1-amine
CID 115799813
N-(2-methylpropyl)-1-pyridin-3-ylbutan-1-amine
CID 104581333
(1S)-2-(methylamino)-1-pyridin-3-ylethanol
CID 10171254
N-tert-butyl-3-methyl-2-pyridin-3-ylpentan-1-amine
CID 80522237
N-ethyl-3,5-dimethyl-2-pyridin-3-ylhexan-1-amine
CID 114284954
2-(3,5-dimethylphenyl)-N,3-dimethylhexan-1-amine
CID 107887092
N-methyl-2-(4-propan-2-ylphenyl)-2-pyridin-3-ylethanamine
CID 116824741
1-phenyl-N-[(1R)-1-pyridin-3-ylethyl]butan-1-amine
CID 81406901
3-(3-ethyl-2-methyl-1-pyridin-3-ylhexyl)pyridine
CID 57104377
(1R)-N-methyl-1-pyridin-3-ylethanamine
CID 26248773
N-methyl-N-(1-pyridin-3-ylethyl)propan-1-amine
CID 143947974

Frequently Asked Questions

What is the IUPAC name of N,3-dimethyl-2-pyridin-3-ylhexan-1-amine?
The IUPAC name of N,3-dimethyl-2-pyridin-3-ylhexan-1-amine (CID 107887227) is N,3-dimethyl-2-pyridin-3-ylhexan-1-amine.
What is the SMILES notation for N,3-dimethyl-2-pyridin-3-ylhexan-1-amine?
The canonical SMILES for N,3-dimethyl-2-pyridin-3-ylhexan-1-amine is CCCC(C)C(CNC)c1cccnc1.
What is the InChIKey of N,3-dimethyl-2-pyridin-3-ylhexan-1-amine?
The InChIKey is SOLGYNSUDUDCHC-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H22N2/c1-4-6-11(2)13(10-14-3)12-7-5-8-15-9-12/h5,7-9,11,13-14H,4,6,10H2,1-3H3.
What are the key properties of N,3-dimethyl-2-pyridin-3-ylhexan-1-amine?
N,3-dimethyl-2-pyridin-3-ylhexan-1-amine has a molecular weight of 206.33 g/mol, XLogP of 2.82, 6 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N,3-dimethyl-2-pyridin-3-ylhexan-1-amine is sourced from PubChem (CID 107887227), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).