(5-methyl-2,3-dihydropyridin-6-yl)methanamine

C7H12N2 — CID 145066357

IUPAC(5-methyl-2,3-dihydropyridin-6-yl)methanamine
SMILESCC1=CCCN=C1CN
InChIInChI=1S/C7H12N2/c1-6-3-2-4-9-7(6)5-8/h3H,2,4-5,8H2,1H3
InChIKeyGGZOLJGJLBBOGG-UHFFFAOYSA-N
MW124.19 g/mol
LogP0.74
Rot. Bonds1

About (5-methyl-2,3-dihydropyridin-6-yl)methanamine

(5-methyl-2,3-dihydropyridin-6-yl)methanamine (PubChem CID 145066357) has the molecular formula C7H12N2 and a molecular weight of 124.19 g/mol. Its IUPAC name is (5-methyl-2,3-dihydropyridin-6-yl)methanamine.

Molecular Properties

Compound Name(5-methyl-2,3-dihydropyridin-6-yl)methanamine
PubChem CID145066357
Molecular FormulaC7H12N2
Molecular Weight124.19 g/mol
Exact Mass124.10
IUPAC Name(5-methyl-2,3-dihydropyridin-6-yl)methanamine
SMILESCC1=CCCN=C1CN
InChIInChI=1S/C7H12N2/c1-6-3-2-4-9-7(6)5-8/h3H,2,4-5,8H2,1H3
InChIKeyGGZOLJGJLBBOGG-UHFFFAOYSA-N
XLogP0.74
TPSA38.38 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds1
Heavy Atoms9
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500124.19
LogP ≤ 50.74
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Related Compounds

methyl-[(E)-3-methylpent-3-en-2-ylidene]azanium
CID 139212201
methyl-[(Z)-3-methylpent-3-en-2-ylidene]azanium
CID 139212202
4,6-Dimethyl-2,3-dihydropyridine
CID 20753020
(4-methyl-2H-pyrrol-5-yl)methanamine
CID 57746114
5,6-Dimethyl-2,3-dihydropyridine
CID 57840662
(E)-3-(3,4-dihydro-2H-pyrrol-5-yl)-2-methylprop-2-en-1-amine
CID 69247064
2,3-Dihydropyridin-6-ylmethanamine
CID 70426662
4-methyl-2H-pyridin-3-imine
CID 89382802
(E)-4-imino-2-methylpent-2-en-1-amine
CID 118534600
(Z)-2-methyliminohex-3-en-1-amine
CID 123256608
(4,6-Dimethyl-2,3-dihydropyridin-3-yl)methanamine
CID 123421069
2-N,5-dimethylhex-4-ene-2,3-diimine
CID 123546586

Frequently Asked Questions

What is the IUPAC name of (5-methyl-2,3-dihydropyridin-6-yl)methanamine?
The IUPAC name of (5-methyl-2,3-dihydropyridin-6-yl)methanamine (CID 145066357) is (5-methyl-2,3-dihydropyridin-6-yl)methanamine.
What is the SMILES notation for (5-methyl-2,3-dihydropyridin-6-yl)methanamine?
The canonical SMILES for (5-methyl-2,3-dihydropyridin-6-yl)methanamine is CC1=CCCN=C1CN.
What is the InChIKey of (5-methyl-2,3-dihydropyridin-6-yl)methanamine?
The InChIKey is GGZOLJGJLBBOGG-UHFFFAOYSA-N. The full InChI is InChI=1S/C7H12N2/c1-6-3-2-4-9-7(6)5-8/h3H,2,4-5,8H2,1H3.
What are the key properties of (5-methyl-2,3-dihydropyridin-6-yl)methanamine?
(5-methyl-2,3-dihydropyridin-6-yl)methanamine has a molecular weight of 124.19 g/mol, XLogP of 0.74, 1 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for (5-methyl-2,3-dihydropyridin-6-yl)methanamine is sourced from PubChem (CID 145066357), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).