N-(1-cyclopropylidene-3-methylpentyl)-2,3-dihydropyridin-6-amine

C14H22N2 — CID 123649739

IUPACN-(1-cyclopropylidene-3-methylpentyl)-2,3-dihydropyridin-6-amine
SMILESCCC(C)CC(NC1=NCCC=C1)=C1CC1
InChIInChI=1S/C14H22N2/c1-3-11(2)10-13(12-7-8-12)16-14-6-4-5-9-15-14/h4,6,11H,3,5,7-10H2,1-2H3,(H,15,16)
InChIKeyYZUSNYAXLSDTTG-UHFFFAOYSA-N
MW218.34 g/mol
LogP3.42
Rot. Bonds4

About N-(1-cyclopropylidene-3-methylpentyl)-2,3-dihydropyridin-6-amine

N-(1-cyclopropylidene-3-methylpentyl)-2,3-dihydropyridin-6-amine (PubChem CID 123649739) has the molecular formula C14H22N2 and a molecular weight of 218.34 g/mol. Its IUPAC name is N-(1-cyclopropylidene-3-methylpentyl)-2,3-dihydropyridin-6-amine.

Molecular Properties

Compound NameN-(1-cyclopropylidene-3-methylpentyl)-2,3-dihydropyridin-6-amine
PubChem CID123649739
Molecular FormulaC14H22N2
Molecular Weight218.34 g/mol
Exact Mass218.18
IUPAC NameN-(1-cyclopropylidene-3-methylpentyl)-2,3-dihydropyridin-6-amine
SMILESCCC(C)CC(NC1=NCCC=C1)=C1CC1
InChIInChI=1S/C14H22N2/c1-3-11(2)10-13(12-7-8-12)16-14-6-4-5-9-15-14/h4,6,11H,3,5,7-10H2,1-2H3,(H,15,16)
InChIKeyYZUSNYAXLSDTTG-UHFFFAOYSA-N
XLogP3.42
TPSA24.39 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds4
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500218.34
LogP ≤ 53.42
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Related Compounds

5-methyl-N-(4-methylhex-1-en-3-yl)-2-azabicyclo[4.1.0]hepta-2,4-dien-3-amine
CID 123861376
(2E)-N-(1-cyclopropylethenyl)-N'-ethenyl-2-[4-(2-methylprop-1-enyl)cyclohexa-2,4-dien-1-ylidene]ethanimidamide
CID 129169649
ethane;5-methyl-1a,4,7,7b-tetrahydro-1H-cyclopropa[f]quinazoline
CID 144041215
1-methyl-N-(2-methylpropyl)-2-azabicyclo[5.1.0]oct-4-en-3-imine
CID 155030454
2-Ethyl-3-methyl-1,4,4a,7-tetrahydro-1,8-naphthyridine
CID 163562000
2-ethyl-6-methyl-4-(6-methylcyclohexa-1,3-dien-1-yl)-6,7-dihydro-3H-1,3,5-triazepine
CID 163735879
5-methyl-1a,4,7,7b-tetrahydro-1H-cyclopropa[f]quinazoline
CID 144041216

Frequently Asked Questions

What is the IUPAC name of N-(1-cyclopropylidene-3-methylpentyl)-2,3-dihydropyridin-6-amine?
The IUPAC name of N-(1-cyclopropylidene-3-methylpentyl)-2,3-dihydropyridin-6-amine (CID 123649739) is N-(1-cyclopropylidene-3-methylpentyl)-2,3-dihydropyridin-6-amine.
What is the SMILES notation for N-(1-cyclopropylidene-3-methylpentyl)-2,3-dihydropyridin-6-amine?
The canonical SMILES for N-(1-cyclopropylidene-3-methylpentyl)-2,3-dihydropyridin-6-amine is CCC(C)CC(NC1=NCCC=C1)=C1CC1.
What is the InChIKey of N-(1-cyclopropylidene-3-methylpentyl)-2,3-dihydropyridin-6-amine?
The InChIKey is YZUSNYAXLSDTTG-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H22N2/c1-3-11(2)10-13(12-7-8-12)16-14-6-4-5-9-15-14/h4,6,11H,3,5,7-10H2,1-2H3,(H,15,16).
What are the key properties of N-(1-cyclopropylidene-3-methylpentyl)-2,3-dihydropyridin-6-amine?
N-(1-cyclopropylidene-3-methylpentyl)-2,3-dihydropyridin-6-amine has a molecular weight of 218.34 g/mol, XLogP of 3.42, 4 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N-(1-cyclopropylidene-3-methylpentyl)-2,3-dihydropyridin-6-amine is sourced from PubChem (CID 123649739), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).