(Z)-3-tert-butylimino-1-cyclohexylprop-1-en-1-amine

C13H24N2 — CID 135076649

IUPAC(Z)-3-tert-butylimino-1-cyclohexylprop-1-en-1-amine
SMILESCC(C)(C)/N=C/C=C(\N)C1CCCCC1
InChIInChI=1S/C13H24N2/c1-13(2,3)15-10-9-12(14)11-7-5-4-6-8-11/h9-11H,4-8,14H2,1-3H3/b12-9-,15-10+
InChIKeyUVJNSEHMAGBEKS-LURFLBPHSA-N
MW208.35 g/mol
LogP3.28
Rot. Bonds2

About (Z)-3-tert-butylimino-1-cyclohexylprop-1-en-1-amine

(Z)-3-tert-butylimino-1-cyclohexylprop-1-en-1-amine (PubChem CID 135076649) has the molecular formula C13H24N2 and a molecular weight of 208.35 g/mol. Its IUPAC name is (Z)-3-tert-butylimino-1-cyclohexylprop-1-en-1-amine.

Molecular Properties

Compound Name(Z)-3-tert-butylimino-1-cyclohexylprop-1-en-1-amine
PubChem CID135076649
Molecular FormulaC13H24N2
Molecular Weight208.35 g/mol
Exact Mass208.19
IUPAC Name(Z)-3-tert-butylimino-1-cyclohexylprop-1-en-1-amine
SMILESCC(C)(C)/N=C/C=C(\N)C1CCCCC1
InChIInChI=1S/C13H24N2/c1-13(2,3)15-10-9-12(14)11-7-5-4-6-8-11/h9-11H,4-8,14H2,1-3H3/b12-9-,15-10+
InChIKeyUVJNSEHMAGBEKS-LURFLBPHSA-N
XLogP3.28
TPSA38.38 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds2
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500208.35
LogP ≤ 53.28
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'imine_1', 'substructure': 'N/A'}

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Related Compounds

4a,5,6,7,8,9,10,10a-Octahydrocycloocta[b]pyridin-4-amine
CID 54186477
3-(cyclohexylmethyl)-3-methyl-2H-pyridine-2,5-diamine
CID 69268699
N-[(E)-1-(3,4-dihydro-2H-pyrrol-5-yl)prop-1-en-2-yl]-1-methylcyclohexan-1-amine
CID 70574446
(2E)-2-(ethylideneamino)-5-methylnona-2,8-dien-4-amine
CID 89503499
6-Ethyl-4-ethylimino-1-methyliminonon-2-en-3-amine
CID 123490439
(3E)-4-(ethylideneamino)-2-imino-8-propan-2-yldeca-3,9-dien-3-amine
CID 126599255
(Z)-N-[(Z)-4-propylhept-2-en-3-yl]but-2-en-1-imine
CID 135141009
2-cyclohexyl-5-methyl-4H-azepine
CID 137504088
ethane;(Z)-1-iminohept-2-en-3-amine;5-methylnonane;prop-1-ene
CID 141876608
ethanamine;4-methylheptane;(E)-3-methyl-N-prop-1-en-2-ylhex-2-en-1-imine
CID 141877387
butane;(Z)-1-N-ethyl-3-N-methylidenehept-2-ene-1,3-diimine;4-methylheptane
CID 141939686
(E)-N-(cyclohexylmethyl)-1-methyliminopent-2-en-2-amine
CID 143937071

Frequently Asked Questions

What is the IUPAC name of (Z)-3-tert-butylimino-1-cyclohexylprop-1-en-1-amine?
The IUPAC name of (Z)-3-tert-butylimino-1-cyclohexylprop-1-en-1-amine (CID 135076649) is (Z)-3-tert-butylimino-1-cyclohexylprop-1-en-1-amine.
What is the SMILES notation for (Z)-3-tert-butylimino-1-cyclohexylprop-1-en-1-amine?
The canonical SMILES for (Z)-3-tert-butylimino-1-cyclohexylprop-1-en-1-amine is CC(C)(C)/N=C/C=C(\N)C1CCCCC1.
What is the InChIKey of (Z)-3-tert-butylimino-1-cyclohexylprop-1-en-1-amine?
The InChIKey is UVJNSEHMAGBEKS-LURFLBPHSA-N. The full InChI is InChI=1S/C13H24N2/c1-13(2,3)15-10-9-12(14)11-7-5-4-6-8-11/h9-11H,4-8,14H2,1-3H3/b12-9-,15-10+.
What are the key properties of (Z)-3-tert-butylimino-1-cyclohexylprop-1-en-1-amine?
(Z)-3-tert-butylimino-1-cyclohexylprop-1-en-1-amine has a molecular weight of 208.35 g/mol, XLogP of 3.28, 2 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for (Z)-3-tert-butylimino-1-cyclohexylprop-1-en-1-amine is sourced from PubChem (CID 135076649), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).