N-[[(1R)-2-ethyl-3-methylcyclopropyl]methyl]acetamide

C9H17NO — CID 58899414

IUPACN-[[(1R)-2-ethyl-3-methylcyclopropyl]methyl]acetamide
SMILESCCC1C(C)[C@H]1CNC(C)=O
InChIInChI=1S/C9H17NO/c1-4-8-6(2)9(8)5-10-7(3)11/h6,8-9H,4-5H2,1-3H3,(H,10,11)/t6?,8?,9-/m1/s1
InChIKeyNBCMWOWPMFZBNK-KPIFQKDSSA-N
MW155.24 g/mol
LogP1.41
Rot. Bonds3

About N-[[(1R)-2-ethyl-3-methylcyclopropyl]methyl]acetamide

N-[[(1R)-2-ethyl-3-methylcyclopropyl]methyl]acetamide (PubChem CID 58899414) has the molecular formula C9H17NO and a molecular weight of 155.24 g/mol. Its IUPAC name is N-[[(1R)-2-ethyl-3-methylcyclopropyl]methyl]acetamide.

Molecular Properties

Compound NameN-[[(1R)-2-ethyl-3-methylcyclopropyl]methyl]acetamide
PubChem CID58899414
Molecular FormulaC9H17NO
Molecular Weight155.24 g/mol
Exact Mass155.13
IUPAC NameN-[[(1R)-2-ethyl-3-methylcyclopropyl]methyl]acetamide
SMILESCCC1C(C)[C@H]1CNC(C)=O
InChIInChI=1S/C9H17NO/c1-4-8-6(2)9(8)5-10-7(3)11/h6,8-9H,4-5H2,1-3H3,(H,10,11)/t6?,8?,9-/m1/s1
InChIKeyNBCMWOWPMFZBNK-KPIFQKDSSA-N
XLogP1.41
TPSA29.10 Ų
H-Bond Donors1
H-Bond Acceptors1
Rotatable Bonds3
Heavy Atoms11
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500155.24
LogP ≤ 51.41
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 101

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Frequently Asked Questions

What is the IUPAC name of N-[[(1R)-2-ethyl-3-methylcyclopropyl]methyl]acetamide?
The IUPAC name of N-[[(1R)-2-ethyl-3-methylcyclopropyl]methyl]acetamide (CID 58899414) is N-[[(1R)-2-ethyl-3-methylcyclopropyl]methyl]acetamide.
What is the SMILES notation for N-[[(1R)-2-ethyl-3-methylcyclopropyl]methyl]acetamide?
The canonical SMILES for N-[[(1R)-2-ethyl-3-methylcyclopropyl]methyl]acetamide is CCC1C(C)[C@H]1CNC(C)=O.
What is the InChIKey of N-[[(1R)-2-ethyl-3-methylcyclopropyl]methyl]acetamide?
The InChIKey is NBCMWOWPMFZBNK-KPIFQKDSSA-N. The full InChI is InChI=1S/C9H17NO/c1-4-8-6(2)9(8)5-10-7(3)11/h6,8-9H,4-5H2,1-3H3,(H,10,11)/t6?,8?,9-/m1/s1.
What are the key properties of N-[[(1R)-2-ethyl-3-methylcyclopropyl]methyl]acetamide?
N-[[(1R)-2-ethyl-3-methylcyclopropyl]methyl]acetamide has a molecular weight of 155.24 g/mol, XLogP of 1.41, 3 rotatable bonds, 1 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for N-[[(1R)-2-ethyl-3-methylcyclopropyl]methyl]acetamide is sourced from PubChem (CID 58899414), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).