3-methyl-N-(3-methylbutyl)pyridin-2-amine

C11H18N2 — CID 60960877

IUPAC3-methyl-N-(3-methylbutyl)pyridin-2-amine
SMILESCc1cccnc1NCCC(C)C
InChIInChI=1S/C11H18N2/c1-9(2)6-8-13-11-10(3)5-4-7-12-11/h4-5,7,9H,6,8H2,1-3H3,(H,12,13)
InChIKeyOKVLVFKLKMCGEH-UHFFFAOYSA-N
MW178.28 g/mol
LogP2.85
Rot. Bonds4

About 3-methyl-N-(3-methylbutyl)pyridin-2-amine

3-methyl-N-(3-methylbutyl)pyridin-2-amine (PubChem CID 60960877) has the molecular formula C11H18N2 and a molecular weight of 178.28 g/mol. Its IUPAC name is 3-methyl-N-(3-methylbutyl)pyridin-2-amine.

Molecular Properties

Compound Name3-methyl-N-(3-methylbutyl)pyridin-2-amine
PubChem CID60960877
Molecular FormulaC11H18N2
Molecular Weight178.28 g/mol
Exact Mass178.15
IUPAC Name3-methyl-N-(3-methylbutyl)pyridin-2-amine
SMILESCc1cccnc1NCCC(C)C
InChIInChI=1S/C11H18N2/c1-9(2)6-8-13-11-10(3)5-4-7-12-11/h4-5,7,9H,6,8H2,1-3H3,(H,12,13)
InChIKeyOKVLVFKLKMCGEH-UHFFFAOYSA-N
XLogP2.85
TPSA24.92 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds4
Heavy Atoms13
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500178.28
LogP ≤ 52.85
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Related Compounds

2-methyl-N-(3-methyl-2-pyridinyl)butane-1,4-diamine
CID 66106814
N'-(3-methyl-2-pyridinyl)hexane-1,6-diamine
CID 107844649
N',N'-diethyl-N-(3-methyl-2-pyridinyl)ethane-1,2-diamine
CID 62253337
3-methyl-N-(2-methyl-3-methylsulfanylpropyl)pyridin-2-amine
CID 63966599
2-methyl-1-[(3-methyl-2-pyridinyl)amino]propan-2-ol
CID 65109200
2-N-(3-methylbutyl)pyridine-2,3,4-triamine
CID 130593940
3-methyl-N-(3-phenoxypropyl)pyridin-2-amine
CID 62379676
6-N-(3-methylbutyl)-4-N-(2-methylphenyl)pyrimidine-4,5,6-triamine
CID 19147842
2-[(3-methyl-2-pyridinyl)amino]acetic acid
CID 83826873
(2S)-4-[(3-amino-2-pyridinyl)amino]butan-2-ol
CID 86323908
N-(4-methylpentyl)-2-(propylamino)pyridine-3-sulfonamide
CID 63003516
3-[(2-methylphenyl)sulfanylmethyl]-N-propylpyridin-2-amine
CID 62468389

Frequently Asked Questions

What is the IUPAC name of 3-methyl-N-(3-methylbutyl)pyridin-2-amine?
The IUPAC name of 3-methyl-N-(3-methylbutyl)pyridin-2-amine (CID 60960877) is 3-methyl-N-(3-methylbutyl)pyridin-2-amine.
What is the SMILES notation for 3-methyl-N-(3-methylbutyl)pyridin-2-amine?
The canonical SMILES for 3-methyl-N-(3-methylbutyl)pyridin-2-amine is Cc1cccnc1NCCC(C)C.
What is the InChIKey of 3-methyl-N-(3-methylbutyl)pyridin-2-amine?
The InChIKey is OKVLVFKLKMCGEH-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H18N2/c1-9(2)6-8-13-11-10(3)5-4-7-12-11/h4-5,7,9H,6,8H2,1-3H3,(H,12,13).
What are the key properties of 3-methyl-N-(3-methylbutyl)pyridin-2-amine?
3-methyl-N-(3-methylbutyl)pyridin-2-amine has a molecular weight of 178.28 g/mol, XLogP of 2.85, 4 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 3-methyl-N-(3-methylbutyl)pyridin-2-amine is sourced from PubChem (CID 60960877), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).