ethyl 3-(cyclopropylamino)pentanoate

C10H19NO2 — CID 154585687

IUPACethyl 3-(cyclopropylamino)pentanoate
SMILESCCOC(=O)CC(CC)NC1CC1
InChIInChI=1S/C10H19NO2/c1-3-8(11-9-5-6-9)7-10(12)13-4-2/h8-9,11H,3-7H2,1-2H3
InChIKeyRPFZMJKLQWUBJU-UHFFFAOYSA-N
MW185.27 g/mol
LogP1.47
Rot. Bonds6

About ethyl 3-(cyclopropylamino)pentanoate

ethyl 3-(cyclopropylamino)pentanoate (PubChem CID 154585687) has the molecular formula C10H19NO2 and a molecular weight of 185.27 g/mol. Its IUPAC name is ethyl 3-(cyclopropylamino)pentanoate.

Molecular Properties

Compound Nameethyl 3-(cyclopropylamino)pentanoate
PubChem CID154585687
Molecular FormulaC10H19NO2
Molecular Weight185.27 g/mol
Exact Mass185.14
IUPAC Nameethyl 3-(cyclopropylamino)pentanoate
SMILESCCOC(=O)CC(CC)NC1CC1
InChIInChI=1S/C10H19NO2/c1-3-8(11-9-5-6-9)7-10(12)13-4-2/h8-9,11H,3-7H2,1-2H3
InChIKeyRPFZMJKLQWUBJU-UHFFFAOYSA-N
XLogP1.47
TPSA38.33 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds6
Heavy Atoms13
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500185.27
LogP ≤ 51.47
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

Ethyl 3-((propan-2-yl)amino)propanoate
CID 12636111
Ethyl 3-(cyclopropylamino)propanoate
CID 13456042
Methyl 3-((oxan-4-yl)amino)propanoate
CID 43608622
Ethyl 3-(cyclopropylamino)-2-methylpropanoate
CID 61717320
Ethyl 3-(propylamino)butanoate
CID 242423
methyl (3S)-3-(methylamino)pentanoate hydrochloride
CID 177798129
Ethyl 3-(cyclopropylamino)butanoate
CID 61717813
Ethyl 3-(propan-2-ylamino)butanoate
CID 9989709
3-Cyclopropylamino-4-methyl-pentanoic acid ethyl ester
CID 102538604
Ethyl 3-(cyclopropylamino)hexanoate
CID 154585691
ethyl (3R)-3-(cyclopropylamino)-4,4,4-trifluorobutanoate
CID 129451970
ethyl (3S)-3-(cyclopropylamino)-4,4,4-trifluorobutanoate
CID 129451971

Frequently Asked Questions

What is the IUPAC name of ethyl 3-(cyclopropylamino)pentanoate?
The IUPAC name of ethyl 3-(cyclopropylamino)pentanoate (CID 154585687) is ethyl 3-(cyclopropylamino)pentanoate.
What is the SMILES notation for ethyl 3-(cyclopropylamino)pentanoate?
The canonical SMILES for ethyl 3-(cyclopropylamino)pentanoate is CCOC(=O)CC(CC)NC1CC1.
What is the InChIKey of ethyl 3-(cyclopropylamino)pentanoate?
The InChIKey is RPFZMJKLQWUBJU-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H19NO2/c1-3-8(11-9-5-6-9)7-10(12)13-4-2/h8-9,11H,3-7H2,1-2H3.
What are the key properties of ethyl 3-(cyclopropylamino)pentanoate?
ethyl 3-(cyclopropylamino)pentanoate has a molecular weight of 185.27 g/mol, XLogP of 1.47, 6 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for ethyl 3-(cyclopropylamino)pentanoate is sourced from PubChem (CID 154585687), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).