N-ethyl-N-(5-methyl-2-propan-2-ylcyclohexyl)formamide

C13H25NO — CID 25195885

IUPACN-ethyl-N-(5-methyl-2-propan-2-ylcyclohexyl)formamide
SMILESCCN(C=O)C1CC(C)CCC1C(C)C
InChIInChI=1S/C13H25NO/c1-5-14(9-15)13-8-11(4)6-7-12(13)10(2)3/h9-13H,5-8H2,1-4H3
InChIKeyAARLMSLPBIIKNP-UHFFFAOYSA-N
MW211.35 g/mol
LogP2.93
Rot. Bonds4

About N-ethyl-N-(5-methyl-2-propan-2-ylcyclohexyl)formamide

N-ethyl-N-(5-methyl-2-propan-2-ylcyclohexyl)formamide (PubChem CID 25195885) has the molecular formula C13H25NO and a molecular weight of 211.35 g/mol. Its IUPAC name is N-ethyl-N-(5-methyl-2-propan-2-ylcyclohexyl)formamide.

Molecular Properties

Compound NameN-ethyl-N-(5-methyl-2-propan-2-ylcyclohexyl)formamide
PubChem CID25195885
Molecular FormulaC13H25NO
Molecular Weight211.35 g/mol
Exact Mass211.19
IUPAC NameN-ethyl-N-(5-methyl-2-propan-2-ylcyclohexyl)formamide
SMILESCCN(C=O)C1CC(C)CCC1C(C)C
InChIInChI=1S/C13H25NO/c1-5-14(9-15)13-8-11(4)6-7-12(13)10(2)3/h9-13H,5-8H2,1-4H3
InChIKeyAARLMSLPBIIKNP-UHFFFAOYSA-N
XLogP2.93
TPSA20.31 Ų
H-Bond Donors
H-Bond Acceptors1
Rotatable Bonds4
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500211.35
LogP ≤ 52.93
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 101

Computed Properties (RDKit)

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

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Related Compounds

N-ethyl-N-(5-methyl-2-propan-2-ylcyclohexyl)acetamide
CID 16734901
2,4-dimethyl-1-propan-2-ylcyclohexane;propane
CID 143365202
2-[cyclopropyl-(5-methyl-2-propan-2-ylcyclohexyl)amino]acetic acid
CID 65057481
2-[(5-methyl-2-propan-2-ylcyclohexyl)-prop-2-enylamino]acetic acid
CID 79285316
(1S,2S,4S)-2-ethyl-4-methyl-1-propan-2-ylcyclohexane
CID 166124501
(2S)-4-methyl-1,2-di(propan-2-yl)cyclohexane
CID 169042978
N-[(1S,2S,5R)-5-methyl-2-propan-2-ylcyclohexyl]formamide
CID 59847881
N-(4-methoxyphenyl)-N-[(1R,2S,5R)-5-methyl-2-propan-2-ylcyclohexyl]formamide
CID 168868561
2-butan-2-yl-4-methyl-1-propan-2-ylcyclohexane
CID 173263952
trans-(1S,4R)-2-butan-2-yl-4-methyl-1-propan-2-ylcyclohexane
CID 142957322
N-methyl-N-(5-methyl-2-propan-2-ylcyclohexyl)azetidin-3-amine
CID 66187048
4-N-methyl-4-N-(5-methyl-2-propan-2-ylcyclohexyl)cyclohexane-1,4-diamine
CID 79121112

Frequently Asked Questions

What is the IUPAC name of N-ethyl-N-(5-methyl-2-propan-2-ylcyclohexyl)formamide?
The IUPAC name of N-ethyl-N-(5-methyl-2-propan-2-ylcyclohexyl)formamide (CID 25195885) is N-ethyl-N-(5-methyl-2-propan-2-ylcyclohexyl)formamide.
What is the SMILES notation for N-ethyl-N-(5-methyl-2-propan-2-ylcyclohexyl)formamide?
The canonical SMILES for N-ethyl-N-(5-methyl-2-propan-2-ylcyclohexyl)formamide is CCN(C=O)C1CC(C)CCC1C(C)C.
What is the InChIKey of N-ethyl-N-(5-methyl-2-propan-2-ylcyclohexyl)formamide?
The InChIKey is AARLMSLPBIIKNP-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H25NO/c1-5-14(9-15)13-8-11(4)6-7-12(13)10(2)3/h9-13H,5-8H2,1-4H3.
What are the key properties of N-ethyl-N-(5-methyl-2-propan-2-ylcyclohexyl)formamide?
N-ethyl-N-(5-methyl-2-propan-2-ylcyclohexyl)formamide has a molecular weight of 211.35 g/mol, XLogP of 2.93, 4 rotatable bonds, 0 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for N-ethyl-N-(5-methyl-2-propan-2-ylcyclohexyl)formamide is sourced from PubChem (CID 25195885), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).