2-hydrazinyl-1-(4-iodophenyl)-N,N,3-trimethylpentan-3-amine

C14H24IN3 — CID 105240562

IUPAC2-hydrazinyl-1-(4-iodophenyl)-N,N,3-trimethylpentan-3-amine
SMILESCCC(C)(C(Cc1ccc(I)cc1)NN)N(C)C
InChIInChI=1S/C14H24IN3/c1-5-14(2,18(3)4)13(17-16)10-11-6-8-12(15)9-7-11/h6-9,13,17H,5,10,16H2,1-4H3
InChIKeyVULNSOZCCGZCNY-UHFFFAOYSA-N
MW361.27 g/mol
LogP2.40
Rot. Bonds6

About 2-hydrazinyl-1-(4-iodophenyl)-N,N,3-trimethylpentan-3-amine

2-hydrazinyl-1-(4-iodophenyl)-N,N,3-trimethylpentan-3-amine (PubChem CID 105240562) has the molecular formula C14H24IN3 and a molecular weight of 361.27 g/mol. Its IUPAC name is 2-hydrazinyl-1-(4-iodophenyl)-N,N,3-trimethylpentan-3-amine.

Molecular Properties

Compound Name2-hydrazinyl-1-(4-iodophenyl)-N,N,3-trimethylpentan-3-amine
PubChem CID105240562
Molecular FormulaC14H24IN3
Molecular Weight361.27 g/mol
Exact Mass361.10
IUPAC Name2-hydrazinyl-1-(4-iodophenyl)-N,N,3-trimethylpentan-3-amine
SMILESCCC(C)(C(Cc1ccc(I)cc1)NN)N(C)C
InChIInChI=1S/C14H24IN3/c1-5-14(2,18(3)4)13(17-16)10-11-6-8-12(15)9-7-11/h6-9,13,17H,5,10,16H2,1-4H3
InChIKeyVULNSOZCCGZCNY-UHFFFAOYSA-N
XLogP2.40
TPSA41.29 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds6
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500361.27
LogP ≤ 52.40
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

Computed Properties (RDKit)

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

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Related Compounds

1-(3,4-dimethylphenyl)-2-hydrazinyl-N,N,3-trimethylpentan-3-amine
CID 105240604
N,N,3-triethyl-2-hydrazinyl-1-(4-iodophenyl)pentan-3-amine
CID 105241983
[1,1,1-trifluoro-3-(4-iodophenyl)propan-2-yl]hydrazine
CID 105215678
1-(4-ethylphenyl)-2-N,3-N,3-N,3-tetramethylpentane-2,3-diamine
CID 79063641
1-(4-bromophenyl)-2-N-ethyl-3-N,3-N,3-trimethylpentane-2,3-diamine
CID 79064098
[3-(azepan-1-yl)-1-(4-iodophenyl)-3-methylbutan-2-yl]hydrazine
CID 105240327
1-(2,4-difluorophenyl)-2-hydrazinyl-N,N,3-trimethylpentan-3-amine
CID 105240669
1-(3,4-dimethylphenyl)-N,N-diethyl-2-hydrazinyl-3-methylpentan-3-amine
CID 105240894
1-(3-bromo-4-fluorophenyl)-2-N-ethyl-3-N,3-N,3-trimethylpentane-2,3-diamine
CID 79063157
1-(4-iodophenyl)-N,3,3-trimethylbutan-2-amine
CID 65478318
[4,4,4-trifluoro-1-(4-iodophenyl)butan-2-yl]hydrazine
CID 105205984
[1-(4-fluorophenyl)-3-methoxy-3-methylpentan-2-yl]hydrazine
CID 105274321

Frequently Asked Questions

What is the IUPAC name of 2-hydrazinyl-1-(4-iodophenyl)-N,N,3-trimethylpentan-3-amine?
The IUPAC name of 2-hydrazinyl-1-(4-iodophenyl)-N,N,3-trimethylpentan-3-amine (CID 105240562) is 2-hydrazinyl-1-(4-iodophenyl)-N,N,3-trimethylpentan-3-amine.
What is the SMILES notation for 2-hydrazinyl-1-(4-iodophenyl)-N,N,3-trimethylpentan-3-amine?
The canonical SMILES for 2-hydrazinyl-1-(4-iodophenyl)-N,N,3-trimethylpentan-3-amine is CCC(C)(C(Cc1ccc(I)cc1)NN)N(C)C.
What is the InChIKey of 2-hydrazinyl-1-(4-iodophenyl)-N,N,3-trimethylpentan-3-amine?
The InChIKey is VULNSOZCCGZCNY-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H24IN3/c1-5-14(2,18(3)4)13(17-16)10-11-6-8-12(15)9-7-11/h6-9,13,17H,5,10,16H2,1-4H3.
What are the key properties of 2-hydrazinyl-1-(4-iodophenyl)-N,N,3-trimethylpentan-3-amine?
2-hydrazinyl-1-(4-iodophenyl)-N,N,3-trimethylpentan-3-amine has a molecular weight of 361.27 g/mol, XLogP of 2.40, 6 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-hydrazinyl-1-(4-iodophenyl)-N,N,3-trimethylpentan-3-amine is sourced from PubChem (CID 105240562), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).