3-amino-N'-cyclohexyl-N-propan-2-yl-N'-prop-2-enylpropanehydrazide

C15H29N3O — CID 68571883

IUPAC3-amino-N'-cyclohexyl-N-propan-2-yl-N'-prop-2-enylpropanehydrazide
SMILESC=CCN(C1CCCCC1)N(C(=O)CCN)C(C)C
InChIInChI=1S/C15H29N3O/c1-4-12-17(14-8-6-5-7-9-14)18(13(2)3)15(19)10-11-16/h4,13-14H,1,5-12,16H2,2-3H3
InChIKeyWSVOJBDLAOHNFN-UHFFFAOYSA-N
MW267.42 g/mol
LogP2.31
Rot. Bonds7

About 3-amino-N'-cyclohexyl-N-propan-2-yl-N'-prop-2-enylpropanehydrazide

3-amino-N'-cyclohexyl-N-propan-2-yl-N'-prop-2-enylpropanehydrazide (PubChem CID 68571883) has the molecular formula C15H29N3O and a molecular weight of 267.42 g/mol. Its IUPAC name is 3-amino-N'-cyclohexyl-N-propan-2-yl-N'-prop-2-enylpropanehydrazide.

Molecular Properties

Compound Name3-amino-N'-cyclohexyl-N-propan-2-yl-N'-prop-2-enylpropanehydrazide
PubChem CID68571883
Molecular FormulaC15H29N3O
Molecular Weight267.42 g/mol
Exact Mass267.23
IUPAC Name3-amino-N'-cyclohexyl-N-propan-2-yl-N'-prop-2-enylpropanehydrazide
SMILESC=CCN(C1CCCCC1)N(C(=O)CCN)C(C)C
InChIInChI=1S/C15H29N3O/c1-4-12-17(14-8-6-5-7-9-14)18(13(2)3)15(19)10-11-16/h4,13-14H,1,5-12,16H2,2-3H3
InChIKeyWSVOJBDLAOHNFN-UHFFFAOYSA-N
XLogP2.31
TPSA49.57 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds7
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500267.42
LogP ≤ 52.31
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

Computed Properties (RDKit)

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

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Frequently Asked Questions

What is the IUPAC name of 3-amino-N'-cyclohexyl-N-propan-2-yl-N'-prop-2-enylpropanehydrazide?
The IUPAC name of 3-amino-N'-cyclohexyl-N-propan-2-yl-N'-prop-2-enylpropanehydrazide (CID 68571883) is 3-amino-N'-cyclohexyl-N-propan-2-yl-N'-prop-2-enylpropanehydrazide.
What is the SMILES notation for 3-amino-N'-cyclohexyl-N-propan-2-yl-N'-prop-2-enylpropanehydrazide?
The canonical SMILES for 3-amino-N'-cyclohexyl-N-propan-2-yl-N'-prop-2-enylpropanehydrazide is C=CCN(C1CCCCC1)N(C(=O)CCN)C(C)C.
What is the InChIKey of 3-amino-N'-cyclohexyl-N-propan-2-yl-N'-prop-2-enylpropanehydrazide?
The InChIKey is WSVOJBDLAOHNFN-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H29N3O/c1-4-12-17(14-8-6-5-7-9-14)18(13(2)3)15(19)10-11-16/h4,13-14H,1,5-12,16H2,2-3H3.
What are the key properties of 3-amino-N'-cyclohexyl-N-propan-2-yl-N'-prop-2-enylpropanehydrazide?
3-amino-N'-cyclohexyl-N-propan-2-yl-N'-prop-2-enylpropanehydrazide has a molecular weight of 267.42 g/mol, XLogP of 2.31, 7 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 3-amino-N'-cyclohexyl-N-propan-2-yl-N'-prop-2-enylpropanehydrazide is sourced from PubChem (CID 68571883), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).