(Z)-1-[amino(cyclohexylmethyl)amino]prop-1-en-2-amine

C10H21N3 — CID 143858993

IUPAC(Z)-1-[amino(cyclohexylmethyl)amino]prop-1-en-2-amine
SMILESC/C(N)=C/N(N)CC1CCCCC1
InChIInChI=1S/C10H21N3/c1-9(11)7-13(12)8-10-5-3-2-4-6-10/h7,10H,2-6,8,11-12H2,1H3/b9-7-
InChIKeyVJLQBTACKXAIDC-CLFYSBASSA-N
MW183.30 g/mol
LogP1.56
Rot. Bonds3

About (Z)-1-[amino(cyclohexylmethyl)amino]prop-1-en-2-amine

(Z)-1-[amino(cyclohexylmethyl)amino]prop-1-en-2-amine (PubChem CID 143858993) has the molecular formula C10H21N3 and a molecular weight of 183.30 g/mol. Its IUPAC name is (Z)-1-[amino(cyclohexylmethyl)amino]prop-1-en-2-amine.

Molecular Properties

Compound Name(Z)-1-[amino(cyclohexylmethyl)amino]prop-1-en-2-amine
PubChem CID143858993
Molecular FormulaC10H21N3
Molecular Weight183.30 g/mol
Exact Mass183.17
IUPAC Name(Z)-1-[amino(cyclohexylmethyl)amino]prop-1-en-2-amine
SMILESC/C(N)=C/N(N)CC1CCCCC1
InChIInChI=1S/C10H21N3/c1-9(11)7-13(12)8-10-5-3-2-4-6-10/h7,10H,2-6,8,11-12H2,1H3/b9-7-
InChIKeyVJLQBTACKXAIDC-CLFYSBASSA-N
XLogP1.56
TPSA55.28 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms13
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500183.30
LogP ≤ 51.56
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

Computed Properties (RDKit)

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

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Related Compounds

(Z)-1-[amino(5-methylheptyl)amino]hept-1-en-2-amine;ethene
CID 144493060
(Z)-1-[amino-(3-methylcyclohexyl)amino]prop-1-en-2-amine
CID 156218807
(Z)-1-[amino-(3-methylcyclohexyl)amino]pent-1-en-2-amine
CID 156218887
(Z)-1-[amino(2,4-dimethylpentan-2-yl)amino]prop-1-en-2-amine;ethane
CID 156826830
(Z)-2-[amino(ethyl)amino]-1-cyclohexylethenamine
CID 157035467
(Z)-2-[amino(methyl)amino]-1-cyclohexylethenamine
CID 166816484
(Z)-2-[amino(cyclohexyl)amino]-1-cyclohexylethenamine
CID 166956552
(Z)-1-[amino-[(3-ethyl-4,5-dimethylcyclohexyl)methyl]amino]but-1-en-2-amine
CID 169890377
(Z)-1-[amino-[(2R)-2-methylhexyl]amino]but-1-en-2-amine
CID 169952951
(Z)-1-[amino(5-methylhexyl)amino]pent-1-en-2-amine
CID 171532217
(Z)-1-[amino(5-methylhexyl)amino]-4-methylpent-1-en-2-amine
CID 171532237
(Z)-1-[amino(3-methylbutyl)amino]oct-1-en-2-amine
CID 143907009

Frequently Asked Questions

What is the IUPAC name of (Z)-1-[amino(cyclohexylmethyl)amino]prop-1-en-2-amine?
The IUPAC name of (Z)-1-[amino(cyclohexylmethyl)amino]prop-1-en-2-amine (CID 143858993) is (Z)-1-[amino(cyclohexylmethyl)amino]prop-1-en-2-amine.
What is the SMILES notation for (Z)-1-[amino(cyclohexylmethyl)amino]prop-1-en-2-amine?
The canonical SMILES for (Z)-1-[amino(cyclohexylmethyl)amino]prop-1-en-2-amine is C/C(N)=C/N(N)CC1CCCCC1.
What is the InChIKey of (Z)-1-[amino(cyclohexylmethyl)amino]prop-1-en-2-amine?
The InChIKey is VJLQBTACKXAIDC-CLFYSBASSA-N. The full InChI is InChI=1S/C10H21N3/c1-9(11)7-13(12)8-10-5-3-2-4-6-10/h7,10H,2-6,8,11-12H2,1H3/b9-7-.
What are the key properties of (Z)-1-[amino(cyclohexylmethyl)amino]prop-1-en-2-amine?
(Z)-1-[amino(cyclohexylmethyl)amino]prop-1-en-2-amine has a molecular weight of 183.30 g/mol, XLogP of 1.56, 3 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for (Z)-1-[amino(cyclohexylmethyl)amino]prop-1-en-2-amine is sourced from PubChem (CID 143858993), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).