N,1-dimethyl-5-(prop-2-enylideneamino)-3,6-dihydro-2H-pyridin-4-amine

C10H17N3 — CID 144594832

IUPACN,1-dimethyl-5-(prop-2-enylideneamino)-3,6-dihydro-2H-pyridin-4-amine
SMILESC=C/C=N/C1=C(NC)CCN(C)C1
InChIInChI=1S/C10H17N3/c1-4-6-12-10-8-13(3)7-5-9(10)11-2/h4,6,11H,1,5,7-8H2,2-3H3/b12-6+
InChIKeyFWZDBULHJYEEQA-WUXMJOGZSA-N
MW179.27 g/mol
LogP1.01
Rot. Bonds3

About N,1-dimethyl-5-(prop-2-enylideneamino)-3,6-dihydro-2H-pyridin-4-amine

N,1-dimethyl-5-(prop-2-enylideneamino)-3,6-dihydro-2H-pyridin-4-amine (PubChem CID 144594832) has the molecular formula C10H17N3 and a molecular weight of 179.27 g/mol. Its IUPAC name is N,1-dimethyl-5-(prop-2-enylideneamino)-3,6-dihydro-2H-pyridin-4-amine.

Molecular Properties

Compound NameN,1-dimethyl-5-(prop-2-enylideneamino)-3,6-dihydro-2H-pyridin-4-amine
PubChem CID144594832
Molecular FormulaC10H17N3
Molecular Weight179.27 g/mol
Exact Mass179.14
IUPAC NameN,1-dimethyl-5-(prop-2-enylideneamino)-3,6-dihydro-2H-pyridin-4-amine
SMILESC=C/C=N/C1=C(NC)CCN(C)C1
InChIInChI=1S/C10H17N3/c1-4-6-12-10-8-13(3)7-5-9(10)11-2/h4,6,11H,1,5,7-8H2,2-3H3/b12-6+
InChIKeyFWZDBULHJYEEQA-WUXMJOGZSA-N
XLogP1.01
TPSA27.63 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms13
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500179.27
LogP ≤ 51.01
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'imine_1', 'substructure': 'N/A'}

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Related Compounds

2-methyl-3a,7a-dihydro-1H-pyrrolo[3,2-b]pyridine
CID 23545925
(2E)-1-(ethylideneamino)-N-methylhepta-2,6-dien-2-amine
CID 88918559
1,2,3,8a-Tetrahydro-1,5-naphthyridine
CID 91443759
1,7-Dimethyl-3,4,5,5a,6,8-hexahydropyrido[4,3-e][1,4]diazepin-1-ium
CID 123705077
(Z)-N-[(E)-1-(2-methylpiperazin-1-yl)prop-1-en-2-yl]pent-2-en-1-imine
CID 123800549
N'-(2,3-dihydropyridin-6-ylmethyl)-N,N'-dimethylethane-1,2-diamine
CID 126708180
(E)-N-[(Z)-but-2-en-2-yl]-3-piperazin-1-ylpent-3-en-1-imine
CID 134406002
N'-[(E)-5-[(Z)-but-2-en-2-yl]iminopent-2-en-3-yl]-N,N'-diethylethane-1,2-diamine
CID 134406029
(2E,5E)-N-methyl-2-piperazin-1-ylhepta-2,5-dien-1-imine
CID 134406064
(3Z)-N-ethyl-2-methylidene-3-[(2Z)-penta-2,4-dienylidene]pyridin-4-amine
CID 138601574
1-(2,3-Dihydropyridin-5-yl)-1,4-diazepane
CID 139935688
4-N-[2-(dimethylamino)ethyl]-3-methyl-2H-pyridine-3,4-diamine
CID 140591036

Frequently Asked Questions

What is the IUPAC name of N,1-dimethyl-5-(prop-2-enylideneamino)-3,6-dihydro-2H-pyridin-4-amine?
The IUPAC name of N,1-dimethyl-5-(prop-2-enylideneamino)-3,6-dihydro-2H-pyridin-4-amine (CID 144594832) is N,1-dimethyl-5-(prop-2-enylideneamino)-3,6-dihydro-2H-pyridin-4-amine.
What is the SMILES notation for N,1-dimethyl-5-(prop-2-enylideneamino)-3,6-dihydro-2H-pyridin-4-amine?
The canonical SMILES for N,1-dimethyl-5-(prop-2-enylideneamino)-3,6-dihydro-2H-pyridin-4-amine is C=C/C=N/C1=C(NC)CCN(C)C1.
What is the InChIKey of N,1-dimethyl-5-(prop-2-enylideneamino)-3,6-dihydro-2H-pyridin-4-amine?
The InChIKey is FWZDBULHJYEEQA-WUXMJOGZSA-N. The full InChI is InChI=1S/C10H17N3/c1-4-6-12-10-8-13(3)7-5-9(10)11-2/h4,6,11H,1,5,7-8H2,2-3H3/b12-6+.
What are the key properties of N,1-dimethyl-5-(prop-2-enylideneamino)-3,6-dihydro-2H-pyridin-4-amine?
N,1-dimethyl-5-(prop-2-enylideneamino)-3,6-dihydro-2H-pyridin-4-amine has a molecular weight of 179.27 g/mol, XLogP of 1.01, 3 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N,1-dimethyl-5-(prop-2-enylideneamino)-3,6-dihydro-2H-pyridin-4-amine is sourced from PubChem (CID 144594832), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).