2-cyclopentyl-2-(prop-2-enylamino)acetic acid

C10H17NO2 — CID 62352508

IUPAC2-cyclopentyl-2-(prop-2-enylamino)acetic acid
SMILESC=CCNC(C(=O)O)C1CCCC1
InChIInChI=1S/C10H17NO2/c1-2-7-11-9(10(12)13)8-5-3-4-6-8/h2,8-9,11H,1,3-7H2,(H,12,13)
InChIKeyRKMNAGMMPIEWBF-UHFFFAOYSA-N
MW183.25 g/mol
LogP1.41
Rot. Bonds5

About 2-cyclopentyl-2-(prop-2-enylamino)acetic acid

2-cyclopentyl-2-(prop-2-enylamino)acetic acid (PubChem CID 62352508) has the molecular formula C10H17NO2 and a molecular weight of 183.25 g/mol. Its IUPAC name is 2-cyclopentyl-2-(prop-2-enylamino)acetic acid.

Molecular Properties

Compound Name2-cyclopentyl-2-(prop-2-enylamino)acetic acid
PubChem CID62352508
Molecular FormulaC10H17NO2
Molecular Weight183.25 g/mol
Exact Mass183.13
IUPAC Name2-cyclopentyl-2-(prop-2-enylamino)acetic acid
SMILESC=CCNC(C(=O)O)C1CCCC1
InChIInChI=1S/C10H17NO2/c1-2-7-11-9(10(12)13)8-5-3-4-6-8/h2,8-9,11H,1,3-7H2,(H,12,13)
InChIKeyRKMNAGMMPIEWBF-UHFFFAOYSA-N
XLogP1.41
TPSA49.33 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds5
Heavy Atoms13
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500183.25
LogP ≤ 51.41
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 102

Computed Properties (RDKit)

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

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Related Compounds

(2S)-2-cyclohexyl-2-[2-(dimethylamino)ethylamino]acetic acid
CID 67022413
2-[[2-[bis(prop-2-enyl)amino]-2-oxoethyl]amino]-2-cyclopropylacetic acid
CID 62697513
2-cyclohexyl-2-(cyclopropylamino)acetic acid
CID 43754546
2-cyclohexyl-2-(hex-5-enoxycarbonylamino)acetic acid
CID 66781911
(2S)-2-cyclopentyl-2-(2-methylpent-4-enoxycarbonylamino)acetic acid
CID 59584889
(2S)-2-cyclohexyl-2-[[(1R,2R)-2-prop-2-enoxycyclopentyl]oxycarbonylamino]acetic acid
CID 68664954
2-cyclohexyl-2-(hept-6-enoxycarbonylamino)acetic acid
CID 66782617
(2S)-2-cyclohexyl-2-[[(2R)-2-methylpent-4-enoxy]carbonylamino]acetic acid
CID 59279898
2-(2-bromoprop-2-enylamino)-2-cyclopropylacetic acid
CID 62695608
(2S)-2-cyclohexyl-2-[[(2S)-2-(methylamino)but-3-enoyl]amino]acetic acid
CID 143306447
2-(1-cyclohexylethylamino)-N-prop-2-enylacetamide
CID 115903241
2-(cyclopentylamino)pent-4-enoic acid
CID 82933340

Frequently Asked Questions

What is the IUPAC name of 2-cyclopentyl-2-(prop-2-enylamino)acetic acid?
The IUPAC name of 2-cyclopentyl-2-(prop-2-enylamino)acetic acid (CID 62352508) is 2-cyclopentyl-2-(prop-2-enylamino)acetic acid.
What is the SMILES notation for 2-cyclopentyl-2-(prop-2-enylamino)acetic acid?
The canonical SMILES for 2-cyclopentyl-2-(prop-2-enylamino)acetic acid is C=CCNC(C(=O)O)C1CCCC1.
What is the InChIKey of 2-cyclopentyl-2-(prop-2-enylamino)acetic acid?
The InChIKey is RKMNAGMMPIEWBF-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H17NO2/c1-2-7-11-9(10(12)13)8-5-3-4-6-8/h2,8-9,11H,1,3-7H2,(H,12,13).
What are the key properties of 2-cyclopentyl-2-(prop-2-enylamino)acetic acid?
2-cyclopentyl-2-(prop-2-enylamino)acetic acid has a molecular weight of 183.25 g/mol, XLogP of 1.41, 5 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 2-cyclopentyl-2-(prop-2-enylamino)acetic acid is sourced from PubChem (CID 62352508), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).