2-pentyl-2,3-dihydropyridin-3-amine

C10H18N2 — CID 67896766

IUPAC2-pentyl-2,3-dihydropyridin-3-amine
SMILESCCCCCC1N=CC=CC1N
InChIInChI=1S/C10H18N2/c1-2-3-4-7-10-9(11)6-5-8-12-10/h5-6,8-10H,2-4,7,11H2,1H3
InChIKeyLQISZZWRMFZJJK-UHFFFAOYSA-N
MW166.27 g/mol
LogP1.90
Rot. Bonds4

About 2-pentyl-2,3-dihydropyridin-3-amine

2-pentyl-2,3-dihydropyridin-3-amine (PubChem CID 67896766) has the molecular formula C10H18N2 and a molecular weight of 166.27 g/mol. Its IUPAC name is 2-pentyl-2,3-dihydropyridin-3-amine.

Molecular Properties

Compound Name2-pentyl-2,3-dihydropyridin-3-amine
PubChem CID67896766
Molecular FormulaC10H18N2
Molecular Weight166.27 g/mol
Exact Mass166.15
IUPAC Name2-pentyl-2,3-dihydropyridin-3-amine
SMILESCCCCCC1N=CC=CC1N
InChIInChI=1S/C10H18N2/c1-2-3-4-7-10-9(11)6-5-8-12-10/h5-6,8-10H,2-4,7,11H2,1H3
InChIKeyLQISZZWRMFZJJK-UHFFFAOYSA-N
XLogP1.90
TPSA38.38 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds4
Heavy Atoms12
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500166.27
LogP ≤ 51.90
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

Computed Properties (RDKit)

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

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Related Compounds

N-benzyl-2-pentyl-2,3-dihydropyridin-3-amine
CID 70421914
potassium;hexane;hydroxide
CID 158076133
5-undecylcyclopenta-1,3-diene
CID 141280590
(2S,3R,4R)-3-methyl-4-methylsulfanyl-2-pentyl-3,4-dihydro-2H-pyrrol-5-amine
CID 67622840
1,2-dibutyl-2,3-dihydroazepin-3-amine
CID 70625505
4-pentyl-4H-1,3-oxazol-5-one
CID 91113418
3-decylcyclobutene
CID 174421846
4,5-di(undecyl)-4,5-dihydro-1H-imidazole;bis(tris(2,3,4,5,6-pentafluorophenyl)borane)
CID 87792210
CID 18986095
CID 18986095
2-pentyl-2H-thiopyran
CID 526620
5-amino-4-methyl-2-pentyl-3,4-dihydro-2H-pyrrol-3-ol
CID 57241657
2-(2,3-dipentyl-2H-pyridin-3-yl)acetic acid
CID 70264985

Frequently Asked Questions

What is the IUPAC name of 2-pentyl-2,3-dihydropyridin-3-amine?
The IUPAC name of 2-pentyl-2,3-dihydropyridin-3-amine (CID 67896766) is 2-pentyl-2,3-dihydropyridin-3-amine.
What is the SMILES notation for 2-pentyl-2,3-dihydropyridin-3-amine?
The canonical SMILES for 2-pentyl-2,3-dihydropyridin-3-amine is CCCCCC1N=CC=CC1N.
What is the InChIKey of 2-pentyl-2,3-dihydropyridin-3-amine?
The InChIKey is LQISZZWRMFZJJK-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H18N2/c1-2-3-4-7-10-9(11)6-5-8-12-10/h5-6,8-10H,2-4,7,11H2,1H3.
What are the key properties of 2-pentyl-2,3-dihydropyridin-3-amine?
2-pentyl-2,3-dihydropyridin-3-amine has a molecular weight of 166.27 g/mol, XLogP of 1.90, 4 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 2-pentyl-2,3-dihydropyridin-3-amine is sourced from PubChem (CID 67896766), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).