N-buta-2,3-dien-2-ylcyclohexanamine

C10H17N — CID 176535461

IUPACN-buta-2,3-dien-2-ylcyclohexanamine
SMILESC=C=C(C)NC1CCCCC1
InChIInChI=1S/C10H17N/c1-3-9(2)11-10-7-5-4-6-8-10/h10-11H,1,4-8H2,2H3
InChIKeyOMNVWZPMNFLMKD-UHFFFAOYSA-N
MW151.25 g/mol
LogP2.60
Rot. Bonds2

About N-buta-2,3-dien-2-ylcyclohexanamine

N-buta-2,3-dien-2-ylcyclohexanamine (PubChem CID 176535461) has the molecular formula C10H17N and a molecular weight of 151.25 g/mol. Its IUPAC name is N-buta-2,3-dien-2-ylcyclohexanamine.

Molecular Properties

Compound NameN-buta-2,3-dien-2-ylcyclohexanamine
PubChem CID176535461
Molecular FormulaC10H17N
Molecular Weight151.25 g/mol
Exact Mass151.14
IUPAC NameN-buta-2,3-dien-2-ylcyclohexanamine
SMILESC=C=C(C)NC1CCCCC1
InChIInChI=1S/C10H17N/c1-3-9(2)11-10-7-5-4-6-8-10/h10-11H,1,4-8H2,2H3
InChIKeyOMNVWZPMNFLMKD-UHFFFAOYSA-N
XLogP2.60
TPSA12.03 Ų
H-Bond Donors1
H-Bond Acceptors1
Rotatable Bonds2
Heavy Atoms11
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500151.25
LogP ≤ 52.60
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 101

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Related Compounds

2-methylprop-1-ene;N-prop-1-en-2-ylcyclohexanamine
CID 143490405
N-cyclohexylethanethioamide;ethane
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N-cyclododecyl-2-methylprop-2-enamide
CID 66733963
N-prop-1-en-2-ylcyclobutanamine
CID 143509764
methylcyclohexane;2-methylprop-1-ene;N-prop-1-en-2-ylcycloheptanamine
CID 143541445
N-cyclohexyl-2-oxopropanamide
CID 12861109
N-cyclohexyl-2-methylprop-2-enamide;2-methylprop-2-enoic acid
CID 175055430
4-(cyclohexylamino)-3-methylpent-3-en-2-one
CID 74047718
N-(4-hydrazinylidene-5-methyliminopenta-1,2-dien-3-yl)cyclohexanamine
CID 176537644
N-cycloheptyl-3-methylbut-2-enamide
CID 51109528
1-cyclopentyl-3-prop-1-en-2-ylurea
CID 67565838
(E)-N-cyclohexyl-2-methylbut-2-enamide
CID 14316395

Frequently Asked Questions

What is the IUPAC name of N-buta-2,3-dien-2-ylcyclohexanamine?
The IUPAC name of N-buta-2,3-dien-2-ylcyclohexanamine (CID 176535461) is N-buta-2,3-dien-2-ylcyclohexanamine.
What is the SMILES notation for N-buta-2,3-dien-2-ylcyclohexanamine?
The canonical SMILES for N-buta-2,3-dien-2-ylcyclohexanamine is C=C=C(C)NC1CCCCC1.
What is the InChIKey of N-buta-2,3-dien-2-ylcyclohexanamine?
The InChIKey is OMNVWZPMNFLMKD-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H17N/c1-3-9(2)11-10-7-5-4-6-8-10/h10-11H,1,4-8H2,2H3.
What are the key properties of N-buta-2,3-dien-2-ylcyclohexanamine?
N-buta-2,3-dien-2-ylcyclohexanamine has a molecular weight of 151.25 g/mol, XLogP of 2.60, 2 rotatable bonds, 1 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for N-buta-2,3-dien-2-ylcyclohexanamine is sourced from PubChem (CID 176535461), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).