N-but-2-ynyl-2-cyclopentylacetamide

C11H17NO — CID 130621524

IUPACN-but-2-ynyl-2-cyclopentylacetamide
SMILESCC#CCNC(=O)CC1CCCC1
InChIInChI=1S/C11H17NO/c1-2-3-8-12-11(13)9-10-6-4-5-7-10/h10H,4-9H2,1H3,(H,12,13)
InChIKeyZQXSFJKYUSMKEF-UHFFFAOYSA-N
MW179.26 g/mol
LogP1.71
Rot. Bonds3

About N-but-2-ynyl-2-cyclopentylacetamide

N-but-2-ynyl-2-cyclopentylacetamide (PubChem CID 130621524) has the molecular formula C11H17NO and a molecular weight of 179.26 g/mol. Its IUPAC name is N-but-2-ynyl-2-cyclopentylacetamide.

Molecular Properties

Compound NameN-but-2-ynyl-2-cyclopentylacetamide
PubChem CID130621524
Molecular FormulaC11H17NO
Molecular Weight179.26 g/mol
Exact Mass179.13
IUPAC NameN-but-2-ynyl-2-cyclopentylacetamide
SMILESCC#CCNC(=O)CC1CCCC1
InChIInChI=1S/C11H17NO/c1-2-3-8-12-11(13)9-10-6-4-5-7-10/h10H,4-9H2,1H3,(H,12,13)
InChIKeyZQXSFJKYUSMKEF-UHFFFAOYSA-N
XLogP1.71
TPSA29.10 Ų
H-Bond Donors1
H-Bond Acceptors1
Rotatable Bonds3
Heavy Atoms13
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500179.26
LogP ≤ 51.71
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 101

Computed Properties (RDKit)

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

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Related Compounds

N-(cyanomethyl)-2-cyclopentylacetamide
CID 60896119
2-cyclopropyl-N-pent-3-ynylacetamide
CID 104581149
N-(cycloheptylmethyl)but-2-yn-1-amine
CID 115866189
2-cyclopentyl-N-(2-hydroxypropyl)acetamide
CID 60654176
N-[3-(3-chlorophenyl)prop-2-ynyl]-2-cyclopentylacetamide
CID 90548372
methyl 2-[(2-cyclohexylacetyl)amino]acetate
CID 43404765
2-cycloheptyl-N-[(2S)-2-hydroxypropyl]acetamide
CID 103884693
2-cyclohexyl-N-[4-(2-methoxyphenoxy)but-2-ynyl]acetamide
CID 90575527
2-[[2-[(2-cyclopentylacetyl)amino]acetyl]amino]acetic acid
CID 60657329
2-cycloheptyl-N-[2-(propan-2-ylamino)ethyl]acetamide
CID 114458404
3-[(2-cyclopentylacetyl)amino]-N-propylpropanamide
CID 167068164
2-cyclopentyl-N-[2-[(2-cyclopentylacetyl)amino]propyl]acetamide
CID 54786980

Frequently Asked Questions

What is the IUPAC name of N-but-2-ynyl-2-cyclopentylacetamide?
The IUPAC name of N-but-2-ynyl-2-cyclopentylacetamide (CID 130621524) is N-but-2-ynyl-2-cyclopentylacetamide.
What is the SMILES notation for N-but-2-ynyl-2-cyclopentylacetamide?
The canonical SMILES for N-but-2-ynyl-2-cyclopentylacetamide is CC#CCNC(=O)CC1CCCC1.
What is the InChIKey of N-but-2-ynyl-2-cyclopentylacetamide?
The InChIKey is ZQXSFJKYUSMKEF-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H17NO/c1-2-3-8-12-11(13)9-10-6-4-5-7-10/h10H,4-9H2,1H3,(H,12,13).
What are the key properties of N-but-2-ynyl-2-cyclopentylacetamide?
N-but-2-ynyl-2-cyclopentylacetamide has a molecular weight of 179.26 g/mol, XLogP of 1.71, 3 rotatable bonds, 1 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for N-but-2-ynyl-2-cyclopentylacetamide is sourced from PubChem (CID 130621524), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).