2-[cyclopropylmethyl(propan-2-yl)amino]-2-phenylacetohydrazide

C15H23N3O — CID 55214441

IUPAC2-[cyclopropylmethyl(propan-2-yl)amino]-2-phenylacetohydrazide
SMILESCC(C)N(CC1CC1)C(C(=O)NN)c1ccccc1
InChIInChI=1S/C15H23N3O/c1-11(2)18(10-12-8-9-12)14(15(19)17-16)13-6-4-3-5-7-13/h3-7,11-12,14H,8-10,16H2,1-2H3,(H,17,19)
InChIKeyQNKFRWQLUSQPLV-UHFFFAOYSA-N
MW261.37 g/mol
LogP1.84
Rot. Bonds6

About 2-[cyclopropylmethyl(propan-2-yl)amino]-2-phenylacetohydrazide

2-[cyclopropylmethyl(propan-2-yl)amino]-2-phenylacetohydrazide (PubChem CID 55214441) has the molecular formula C15H23N3O and a molecular weight of 261.37 g/mol. Its IUPAC name is 2-[cyclopropylmethyl(propan-2-yl)amino]-2-phenylacetohydrazide.

Molecular Properties

Compound Name2-[cyclopropylmethyl(propan-2-yl)amino]-2-phenylacetohydrazide
PubChem CID55214441
Molecular FormulaC15H23N3O
Molecular Weight261.37 g/mol
Exact Mass261.18
IUPAC Name2-[cyclopropylmethyl(propan-2-yl)amino]-2-phenylacetohydrazide
SMILESCC(C)N(CC1CC1)C(C(=O)NN)c1ccccc1
InChIInChI=1S/C15H23N3O/c1-11(2)18(10-12-8-9-12)14(15(19)17-16)13-6-4-3-5-7-13/h3-7,11-12,14H,8-10,16H2,1-2H3,(H,17,19)
InChIKeyQNKFRWQLUSQPLV-UHFFFAOYSA-N
XLogP1.84
TPSA58.36 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds6
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500261.37
LogP ≤ 51.84
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

Computed Properties (RDKit)

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

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Related Compounds

2-phenyl-2-[propan-2-yl(propyl)amino]acetohydrazide
CID 63573273
2-[methyl(oxan-3-ylmethyl)amino]-2-phenylacetohydrazide
CID 63707200
2-[methyl(3-methylbutyl)amino]-2-phenylacetohydrazide
CID 63578760
2-(dipropylamino)-2-phenylacetohydrazide
CID 63569909
2-[methyl(pentan-2-yl)amino]-2-phenylacetohydrazide
CID 63571994
methyl 3-[cyclopropylmethyl(propan-2-yl)amino]-2-phenylpropanoate
CID 64567315
3-[cyclopropylmethyl(propan-2-yl)amino]-3-phenylpropanimidamide
CID 62778447
N'-tert-butyl-N-(cyclopropylmethyl)-1-phenyl-N-propan-2-ylethane-1,2-diamine
CID 62411806
3-amino-N-(cyclopropylmethyl)-N,2-dimethyl-3-phenylpropanamide;hydrochloride
CID 119737873
2-[methyl(2-propan-2-yloxyethyl)amino]-2-phenylacetohydrazide
CID 81068829
4-[[phenylmethoxycarbonyl(propan-2-yl)amino]methyl]cyclohexane-1-carboxylic acid
CID 139267795
2-[methyl-(2-oxo-2-pyrrolidin-1-ylethyl)amino]-2-phenylacetohydrazide
CID 63584319

Frequently Asked Questions

What is the IUPAC name of 2-[cyclopropylmethyl(propan-2-yl)amino]-2-phenylacetohydrazide?
The IUPAC name of 2-[cyclopropylmethyl(propan-2-yl)amino]-2-phenylacetohydrazide (CID 55214441) is 2-[cyclopropylmethyl(propan-2-yl)amino]-2-phenylacetohydrazide.
What is the SMILES notation for 2-[cyclopropylmethyl(propan-2-yl)amino]-2-phenylacetohydrazide?
The canonical SMILES for 2-[cyclopropylmethyl(propan-2-yl)amino]-2-phenylacetohydrazide is CC(C)N(CC1CC1)C(C(=O)NN)c1ccccc1.
What is the InChIKey of 2-[cyclopropylmethyl(propan-2-yl)amino]-2-phenylacetohydrazide?
The InChIKey is QNKFRWQLUSQPLV-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H23N3O/c1-11(2)18(10-12-8-9-12)14(15(19)17-16)13-6-4-3-5-7-13/h3-7,11-12,14H,8-10,16H2,1-2H3,(H,17,19).
What are the key properties of 2-[cyclopropylmethyl(propan-2-yl)amino]-2-phenylacetohydrazide?
2-[cyclopropylmethyl(propan-2-yl)amino]-2-phenylacetohydrazide has a molecular weight of 261.37 g/mol, XLogP of 1.84, 6 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-[cyclopropylmethyl(propan-2-yl)amino]-2-phenylacetohydrazide is sourced from PubChem (CID 55214441), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).