N-propan-2-yl-2,5-dihydropyridin-6-amine

C8H14N2 — CID 56637934

IUPACN-propan-2-yl-2,5-dihydropyridin-6-amine
SMILESCC(C)NC1=NCC=CC1
InChIInChI=1S/C8H14N2/c1-7(2)10-8-5-3-4-6-9-8/h3-4,7H,5-6H2,1-2H3,(H,9,10)
InChIKeyICMIOIKXNUTBEU-UHFFFAOYSA-N
MW138.21 g/mol
LogP1.34
Rot. Bonds1

About N-propan-2-yl-2,5-dihydropyridin-6-amine

N-propan-2-yl-2,5-dihydropyridin-6-amine (PubChem CID 56637934) has the molecular formula C8H14N2 and a molecular weight of 138.21 g/mol. Its IUPAC name is N-propan-2-yl-2,5-dihydropyridin-6-amine.

Molecular Properties

Compound NameN-propan-2-yl-2,5-dihydropyridin-6-amine
PubChem CID56637934
Molecular FormulaC8H14N2
Molecular Weight138.21 g/mol
Exact Mass138.12
IUPAC NameN-propan-2-yl-2,5-dihydropyridin-6-amine
SMILESCC(C)NC1=NCC=CC1
InChIInChI=1S/C8H14N2/c1-7(2)10-8-5-3-4-6-9-8/h3-4,7H,5-6H2,1-2H3,(H,9,10)
InChIKeyICMIOIKXNUTBEU-UHFFFAOYSA-N
XLogP1.34
TPSA24.39 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds1
Heavy Atoms10
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500138.21
LogP ≤ 51.34
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'isolated_alkene', 'substructure': 'N/A'}

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Related Compounds

2-fluoro-N'-[(E)-3-fluoropent-3-en-2-yl]-N-propan-2-ylethanimidamide
CID 138648416
3-fluoro-N-methyl-2,3-dihydro-1H-pyridin-6-imine
CID 163981498
N,N'-di(propan-2-yl)but-3-enimidamide
CID 134920311
N'-[(E)-4-fluorobut-3-en-2-yl]-N-[(Z)-pent-3-en-2-yl]ethanimidamide
CID 144414903
Qxhjbiadxofkqz-nscuhmnnsa-
CID 13088312
5-ethenyl-2-ethyl-4,5-dihydro-1H-imidazole
CID 19431843
2-methyl-3a,7a-dihydro-1H-benzimidazole
CID 23396723
1-propan-2-yl-N-propyl-2,5-dihydropyridin-6-imine
CID 56605961
N-ethyl-2,5-dihydropyridin-6-amine
CID 56613472
N-methyl-1-propan-2-yl-2,5-dihydropyridin-6-imine
CID 56619013
1-methyl-N-propan-2-yl-2,5-dihydropyridin-6-imine
CID 56620050
N-butyl-1-propan-2-yl-2,5-dihydropyridin-6-imine
CID 56625185

Frequently Asked Questions

What is the IUPAC name of N-propan-2-yl-2,5-dihydropyridin-6-amine?
The IUPAC name of N-propan-2-yl-2,5-dihydropyridin-6-amine (CID 56637934) is N-propan-2-yl-2,5-dihydropyridin-6-amine.
What is the SMILES notation for N-propan-2-yl-2,5-dihydropyridin-6-amine?
The canonical SMILES for N-propan-2-yl-2,5-dihydropyridin-6-amine is CC(C)NC1=NCC=CC1.
What is the InChIKey of N-propan-2-yl-2,5-dihydropyridin-6-amine?
The InChIKey is ICMIOIKXNUTBEU-UHFFFAOYSA-N. The full InChI is InChI=1S/C8H14N2/c1-7(2)10-8-5-3-4-6-9-8/h3-4,7H,5-6H2,1-2H3,(H,9,10).
What are the key properties of N-propan-2-yl-2,5-dihydropyridin-6-amine?
N-propan-2-yl-2,5-dihydropyridin-6-amine has a molecular weight of 138.21 g/mol, XLogP of 1.34, 1 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N-propan-2-yl-2,5-dihydropyridin-6-amine is sourced from PubChem (CID 56637934), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).