N,2-dimethyl-5-(methylideneamino)penta-2,4-dien-1-amine

C8H14N2 — CID 91285492

IUPACN,2-dimethyl-5-(methylideneamino)penta-2,4-dien-1-amine
SMILESC=NC=CC=C(C)CNC
InChIInChI=1S/C8H14N2/c1-8(7-10-3)5-4-6-9-2/h4-6,10H,2,7H2,1,3H3
InChIKeyQTRVWBRMQJQOLU-UHFFFAOYSA-N
MW138.21 g/mol
LogP1.37
Rot. Bonds4

About N,2-dimethyl-5-(methylideneamino)penta-2,4-dien-1-amine

N,2-dimethyl-5-(methylideneamino)penta-2,4-dien-1-amine (PubChem CID 91285492) has the molecular formula C8H14N2 and a molecular weight of 138.21 g/mol. Its IUPAC name is N,2-dimethyl-5-(methylideneamino)penta-2,4-dien-1-amine.

Molecular Properties

Compound NameN,2-dimethyl-5-(methylideneamino)penta-2,4-dien-1-amine
PubChem CID91285492
Molecular FormulaC8H14N2
Molecular Weight138.21 g/mol
Exact Mass138.12
IUPAC NameN,2-dimethyl-5-(methylideneamino)penta-2,4-dien-1-amine
SMILESC=NC=CC=C(C)CNC
InChIInChI=1S/C8H14N2/c1-8(7-10-3)5-4-6-9-2/h4-6,10H,2,7H2,1,3H3
InChIKeyQTRVWBRMQJQOLU-UHFFFAOYSA-N
XLogP1.37
TPSA24.39 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds4
Heavy Atoms10
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500138.21
LogP ≤ 51.37
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

Computed Properties (RDKit)

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

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Related Compounds

(2E,4E)-N-ethenyl-5-fluoro-2-methylhexa-2,4-dien-1-amine
CID 88935075
3-Methyl-1,2-dihydropyridine
CID 5248837
N-methyl-9-methyliminonona-1,3,5,7,8-pentaen-1-amine
CID 53966082
N,6-dimethylhepta-1,3,5-trien-1-amine
CID 58637875
N-[(Z)-[(2E)-2-ethylidene-1H-pyrrol-3-ylidene]methyl]methanimine
CID 59893816
N-[(2-ethylidene-1H-pyrrol-3-ylidene)methyl]methanimine
CID 72589881
(1E,3Z)-N,4-dimethyl-5-[(methylideneamino)-lambda3-iodanylidene]penta-1,3-dien-1-amine
CID 88900185
(Z,3E)-N'-methyl-3-prop-2-enylidenebut-1-ene-1,4-diamine
CID 89218789
(2E,4Z)-2-methyl-5-(methylideneamino)penta-2,4-dien-1-amine
CID 89335536
1-(1,2-dihydropyridin-3-yl)-N-methylmethanamine
CID 89474280
N-butyl-2-[2-(methylideneamino)ethenyl]but-2-en-1-amine
CID 90739426
(E)-2-[(Z)-2-(methylideneamino)ethenyl]but-2-en-1-amine
CID 126672637

Frequently Asked Questions

What is the IUPAC name of N,2-dimethyl-5-(methylideneamino)penta-2,4-dien-1-amine?
The IUPAC name of N,2-dimethyl-5-(methylideneamino)penta-2,4-dien-1-amine (CID 91285492) is N,2-dimethyl-5-(methylideneamino)penta-2,4-dien-1-amine.
What is the SMILES notation for N,2-dimethyl-5-(methylideneamino)penta-2,4-dien-1-amine?
The canonical SMILES for N,2-dimethyl-5-(methylideneamino)penta-2,4-dien-1-amine is C=NC=CC=C(C)CNC.
What is the InChIKey of N,2-dimethyl-5-(methylideneamino)penta-2,4-dien-1-amine?
The InChIKey is QTRVWBRMQJQOLU-UHFFFAOYSA-N. The full InChI is InChI=1S/C8H14N2/c1-8(7-10-3)5-4-6-9-2/h4-6,10H,2,7H2,1,3H3.
What are the key properties of N,2-dimethyl-5-(methylideneamino)penta-2,4-dien-1-amine?
N,2-dimethyl-5-(methylideneamino)penta-2,4-dien-1-amine has a molecular weight of 138.21 g/mol, XLogP of 1.37, 4 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N,2-dimethyl-5-(methylideneamino)penta-2,4-dien-1-amine is sourced from PubChem (CID 91285492), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).