N-amino-N-(diethylamino)-1-methylcyclopenta-2,4-dien-1-amine

C10H19N3 — CID 162226053

IUPACN-amino-N-(diethylamino)-1-methylcyclopenta-2,4-dien-1-amine
SMILESCCN(CC)N(N)C1(C)C=CC=C1
InChIInChI=1S/C10H19N3/c1-4-12(5-2)13(11)10(3)8-6-7-9-10/h6-9H,4-5,11H2,1-3H3
InChIKeyYNLNSODMPXNKGE-UHFFFAOYSA-N
MW181.28 g/mol
LogP1.30
Rot. Bonds4

About N-amino-N-(diethylamino)-1-methylcyclopenta-2,4-dien-1-amine

N-amino-N-(diethylamino)-1-methylcyclopenta-2,4-dien-1-amine (PubChem CID 162226053) has the molecular formula C10H19N3 and a molecular weight of 181.28 g/mol. Its IUPAC name is N-amino-N-(diethylamino)-1-methylcyclopenta-2,4-dien-1-amine.

Molecular Properties

Compound NameN-amino-N-(diethylamino)-1-methylcyclopenta-2,4-dien-1-amine
PubChem CID162226053
Molecular FormulaC10H19N3
Molecular Weight181.28 g/mol
Exact Mass181.16
IUPAC NameN-amino-N-(diethylamino)-1-methylcyclopenta-2,4-dien-1-amine
SMILESCCN(CC)N(N)C1(C)C=CC=C1
InChIInChI=1S/C10H19N3/c1-4-12(5-2)13(11)10(3)8-6-7-9-10/h6-9H,4-5,11H2,1-3H3
InChIKeyYNLNSODMPXNKGE-UHFFFAOYSA-N
XLogP1.30
TPSA32.50 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds4
Heavy Atoms13
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500181.28
LogP ≤ 51.30
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'hydrazine', 'substructure': 'N/A'}, {'alert_name': 'Oxygen-nitrogen_single_bond', 'substructure': 'N/A'}

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Related Compounds

1-(3-Ethenylhept-3-en-2-yl)-1-methylhydrazine
CID 123250175
3,4-Dimethyl-2,7-dihydroazepin-1-amine;ethane
CID 142250956
Ethane;2-methyl-2,5-dihydropyrrol-1-amine
CID 142392343
1-[(2Z)-2-ethylpenta-2,4-dienyl]-1-(2-methylpropyl)hydrazine
CID 146386489
1-Cyclopenta-2,4-dien-1-yl-1-ethylhydrazine
CID 149918330
1,2-Dimethyl-1,2-bis(1-methylcyclopenta-2,4-dien-1-yl)hydrazine
CID 150059268
1-(2,4-Dimethylpenta-1,3-dienyl)-1-(1-ethylcyclopenta-2,4-dien-1-yl)hydrazine
CID 151664684
1-[(2Z,4Z)-3-methylhexa-2,4-dien-2-yl]-1-propan-2-ylhydrazine
CID 155008651
N-amino-N-(dimethylamino)-1-methylcyclopenta-2,4-dien-1-amine;hydrazine
CID 159138819
N-amino-N-(diethylamino)-1-ethylcyclopenta-2,4-dien-1-amine;hydrazine
CID 160540133
N-amino-N-(dimethylamino)-1-ethylcyclopenta-2,4-dien-1-amine;hydrazine
CID 161056183
N-amino-N-(diethylamino)cyclopenta-2,4-dien-1-amine;hydrazine
CID 161675159

Frequently Asked Questions

What is the IUPAC name of N-amino-N-(diethylamino)-1-methylcyclopenta-2,4-dien-1-amine?
The IUPAC name of N-amino-N-(diethylamino)-1-methylcyclopenta-2,4-dien-1-amine (CID 162226053) is N-amino-N-(diethylamino)-1-methylcyclopenta-2,4-dien-1-amine.
What is the SMILES notation for N-amino-N-(diethylamino)-1-methylcyclopenta-2,4-dien-1-amine?
The canonical SMILES for N-amino-N-(diethylamino)-1-methylcyclopenta-2,4-dien-1-amine is CCN(CC)N(N)C1(C)C=CC=C1.
What is the InChIKey of N-amino-N-(diethylamino)-1-methylcyclopenta-2,4-dien-1-amine?
The InChIKey is YNLNSODMPXNKGE-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H19N3/c1-4-12(5-2)13(11)10(3)8-6-7-9-10/h6-9H,4-5,11H2,1-3H3.
What are the key properties of N-amino-N-(diethylamino)-1-methylcyclopenta-2,4-dien-1-amine?
N-amino-N-(diethylamino)-1-methylcyclopenta-2,4-dien-1-amine has a molecular weight of 181.28 g/mol, XLogP of 1.30, 4 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-amino-N-(diethylamino)-1-methylcyclopenta-2,4-dien-1-amine is sourced from PubChem (CID 162226053), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).