N-diazenyl-2-methyl-N-[(Z)-prop-1-enyl]propan-2-amine

C7H15N3 — CID 88859908

IUPACN-diazenyl-2-methyl-N-[(Z)-prop-1-enyl]propan-2-amine
SMILES[H]/N=N/N(/C=C\C)C(C)(C)C
InChIInChI=1S/C7H15N3/c1-5-6-10(9-8)7(2,3)4/h5-6,8H,1-4H3/b6-5-,9-8+
InChIKeyJFCSUQGZGZMNRA-UEPDSTOUSA-N
MW141.22 g/mol
LogP2.57
Rot. Bonds2

About N-diazenyl-2-methyl-N-[(Z)-prop-1-enyl]propan-2-amine

N-diazenyl-2-methyl-N-[(Z)-prop-1-enyl]propan-2-amine (PubChem CID 88859908) has the molecular formula C7H15N3 and a molecular weight of 141.22 g/mol. Its IUPAC name is N-diazenyl-2-methyl-N-[(Z)-prop-1-enyl]propan-2-amine.

Molecular Properties

Compound NameN-diazenyl-2-methyl-N-[(Z)-prop-1-enyl]propan-2-amine
PubChem CID88859908
Molecular FormulaC7H15N3
Molecular Weight141.22 g/mol
Exact Mass141.13
IUPAC NameN-diazenyl-2-methyl-N-[(Z)-prop-1-enyl]propan-2-amine
SMILES[H]/N=N/N(/C=C\C)C(C)(C)C
InChIInChI=1S/C7H15N3/c1-5-6-10(9-8)7(2,3)4/h5-6,8H,1-4H3/b6-5-,9-8+
InChIKeyJFCSUQGZGZMNRA-UEPDSTOUSA-N
XLogP2.57
TPSA39.45 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds2
Heavy Atoms10
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500141.22
LogP ≤ 52.57
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'azo_A(324)', 'substructure': 'N/A'}, {'alert_name': 'diazo_group', '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 N-diazenyl-2-methyl-N-[(Z)-prop-1-enyl]propan-2-amine?
The IUPAC name of N-diazenyl-2-methyl-N-[(Z)-prop-1-enyl]propan-2-amine (CID 88859908) is N-diazenyl-2-methyl-N-[(Z)-prop-1-enyl]propan-2-amine.
What is the SMILES notation for N-diazenyl-2-methyl-N-[(Z)-prop-1-enyl]propan-2-amine?
The canonical SMILES for N-diazenyl-2-methyl-N-[(Z)-prop-1-enyl]propan-2-amine is [H]/N=N/N(/C=C\C)C(C)(C)C.
What is the InChIKey of N-diazenyl-2-methyl-N-[(Z)-prop-1-enyl]propan-2-amine?
The InChIKey is JFCSUQGZGZMNRA-UEPDSTOUSA-N. The full InChI is InChI=1S/C7H15N3/c1-5-6-10(9-8)7(2,3)4/h5-6,8H,1-4H3/b6-5-,9-8+.
What are the key properties of N-diazenyl-2-methyl-N-[(Z)-prop-1-enyl]propan-2-amine?
N-diazenyl-2-methyl-N-[(Z)-prop-1-enyl]propan-2-amine has a molecular weight of 141.22 g/mol, XLogP of 2.57, 2 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N-diazenyl-2-methyl-N-[(Z)-prop-1-enyl]propan-2-amine is sourced from PubChem (CID 88859908), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).