N'-amino-N,N-diethyl-4-methylpent-3-enimidamide

C10H21N3 — CID 23272377

IUPACN'-amino-N,N-diethyl-4-methylpent-3-enimidamide
SMILESCCN(CC)/C(CC=C(C)C)=N\N
InChIInChI=1S/C10H21N3/c1-5-13(6-2)10(12-11)8-7-9(3)4/h7H,5-6,8,11H2,1-4H3/b12-10-
InChIKeyRYWFHJYZNDBSHF-BENRWUELSA-N
MW183.30 g/mol
LogP1.96
Rot. Bonds4

About N'-amino-N,N-diethyl-4-methylpent-3-enimidamide

N'-amino-N,N-diethyl-4-methylpent-3-enimidamide (PubChem CID 23272377) has the molecular formula C10H21N3 and a molecular weight of 183.30 g/mol. Its IUPAC name is N'-amino-N,N-diethyl-4-methylpent-3-enimidamide.

Molecular Properties

Compound NameN'-amino-N,N-diethyl-4-methylpent-3-enimidamide
PubChem CID23272377
Molecular FormulaC10H21N3
Molecular Weight183.30 g/mol
Exact Mass183.17
IUPAC NameN'-amino-N,N-diethyl-4-methylpent-3-enimidamide
SMILESCCN(CC)/C(CC=C(C)C)=N\N
InChIInChI=1S/C10H21N3/c1-5-13(6-2)10(12-11)8-7-9(3)4/h7H,5-6,8,11H2,1-4H3/b12-10-
InChIKeyRYWFHJYZNDBSHF-BENRWUELSA-N
XLogP1.96
TPSA41.62 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds4
Heavy Atoms13
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500183.30
LogP ≤ 51.96
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'hydrazine', 'substructure': 'N/A'}, {'alert_name': 'imine_1', 'substructure': 'N/A'}, {'alert_name': 'imine_2', 'substructure': 'N/A'}, {'alert_name': 'isolated_alkene', 'substructure': 'N/A'}, {'alert_name': 'Oxygen-nitrogen_single_bond', 'substructure': 'N/A'}

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Related Compounds

Fqtlnstuikobcg-wuzdhupesa-
CID 12576986
Fbwwiurjvnwyoc-pfondfgasa-
CID 23266559
Yoxodfgwivdktc-gwvnssqisa-
CID 23272433
Wlazfhhgdwntgp-sqxbumsnsa-
CID 23272434
Urqhmiopmodyon-seyxrhqnsa-
CID 23272502
(1-Methyl-2,5-dihydropyridin-6-ylidene)hydrazine
CID 56628764
(Z)-[1-(5-ethenyl-2H-pyridin-1-yl)-2-methylpropylidene]hydrazine
CID 143183460
N'-butyl-N,N-diethyl-4-methylpent-3-enimidamide
CID 12709000
N,N-diethyl-4-methyl-N'-prop-2-enylpent-3-enimidamide
CID 12709002
N'-[(Z)-[1-(diethylamino)-4-methylpent-3-enylidene]amino]-N,N-diethyl-4-methylpent-3-enimidamide
CID 23266926

Frequently Asked Questions

What is the IUPAC name of N'-amino-N,N-diethyl-4-methylpent-3-enimidamide?
The IUPAC name of N'-amino-N,N-diethyl-4-methylpent-3-enimidamide (CID 23272377) is N'-amino-N,N-diethyl-4-methylpent-3-enimidamide.
What is the SMILES notation for N'-amino-N,N-diethyl-4-methylpent-3-enimidamide?
The canonical SMILES for N'-amino-N,N-diethyl-4-methylpent-3-enimidamide is CCN(CC)/C(CC=C(C)C)=N\N.
What is the InChIKey of N'-amino-N,N-diethyl-4-methylpent-3-enimidamide?
The InChIKey is RYWFHJYZNDBSHF-BENRWUELSA-N. The full InChI is InChI=1S/C10H21N3/c1-5-13(6-2)10(12-11)8-7-9(3)4/h7H,5-6,8,11H2,1-4H3/b12-10-.
What are the key properties of N'-amino-N,N-diethyl-4-methylpent-3-enimidamide?
N'-amino-N,N-diethyl-4-methylpent-3-enimidamide has a molecular weight of 183.30 g/mol, XLogP of 1.96, 4 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N'-amino-N,N-diethyl-4-methylpent-3-enimidamide is sourced from PubChem (CID 23272377), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).