3-amino-N-[[1-(2-hydroxyethyl)cyclopropyl]methyl]oxolane-3-carboxamide

C11H20N2O3 — CID 114756831

IUPAC3-amino-N-[[1-(2-hydroxyethyl)cyclopropyl]methyl]oxolane-3-carboxamide
SMILESNC1(C(=O)NCC2(CCO)CC2)CCOC1
InChIInChI=1S/C11H20N2O3/c12-11(4-6-16-8-11)9(15)13-7-10(1-2-10)3-5-14/h14H,1-8,12H2,(H,13,15)
InChIKeyBOUCUZIIFBQADC-UHFFFAOYSA-N
MW228.29 g/mol
LogP-0.62
Rot. Bonds5

About 3-amino-N-[[1-(2-hydroxyethyl)cyclopropyl]methyl]oxolane-3-carboxamide

3-amino-N-[[1-(2-hydroxyethyl)cyclopropyl]methyl]oxolane-3-carboxamide (PubChem CID 114756831) has the molecular formula C11H20N2O3 and a molecular weight of 228.29 g/mol. Its IUPAC name is 3-amino-N-[[1-(2-hydroxyethyl)cyclopropyl]methyl]oxolane-3-carboxamide.

Molecular Properties

Compound Name3-amino-N-[[1-(2-hydroxyethyl)cyclopropyl]methyl]oxolane-3-carboxamide
PubChem CID114756831
Molecular FormulaC11H20N2O3
Molecular Weight228.29 g/mol
Exact Mass228.15
IUPAC Name3-amino-N-[[1-(2-hydroxyethyl)cyclopropyl]methyl]oxolane-3-carboxamide
SMILESNC1(C(=O)NCC2(CCO)CC2)CCOC1
InChIInChI=1S/C11H20N2O3/c12-11(4-6-16-8-11)9(15)13-7-10(1-2-10)3-5-14/h14H,1-8,12H2,(H,13,15)
InChIKeyBOUCUZIIFBQADC-UHFFFAOYSA-N
XLogP-0.62
TPSA84.58 Ų
H-Bond Donors3
H-Bond Acceptors4
Rotatable Bonds5
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500228.29
LogP ≤ 5-0.62
H-Bond Donors ≤ 53
H-Bond Acceptors ≤ 104

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Related Compounds

1-amino-N-[[1-(2-hydroxyethyl)cyclopentyl]methyl]cyclopropane-1-carboxamide;hydrochloride
CID 119817790
3-amino-N-[4-(hydroxymethyl)oxan-4-yl]oxolane-3-carboxamide
CID 106298704
2-[[(3-aminooxolane-3-carbonyl)amino]methyl]-2-ethylbutanoic acid
CID 115430426
2-[(3-aminooxolane-3-carbonyl)amino]-2-ethylbutanoic acid
CID 79804531
4-amino-N-(2-hydroxyethyl)oxane-4-carboxamide
CID 115293654
3-amino-N-(5-amino-5-oxopentyl)oxolane-3-carboxamide
CID 106235837
3-amino-N-(3-methylbutyl)oxolane-3-carboxamide
CID 64892075
1-(3-aminooxolan-3-yl)ethanone
CID 59621130
3-amino-N-[3-(methylamino)-3-oxopropyl]oxolane-3-carboxamide
CID 64891010
methyl 3-[(3-aminooxolane-3-carbonyl)amino]-2-hydroxypropanoate
CID 107222740
N-[[1-(2-hydroxyethyl)cyclopropyl]methyl]-2-methylthiolane-2-carboxamide
CID 114751515
4-amino-N-[[1-(2-methylpropyl)cyclopentyl]methyl]oxane-4-carboxamide
CID 115295165

Frequently Asked Questions

What is the IUPAC name of 3-amino-N-[[1-(2-hydroxyethyl)cyclopropyl]methyl]oxolane-3-carboxamide?
The IUPAC name of 3-amino-N-[[1-(2-hydroxyethyl)cyclopropyl]methyl]oxolane-3-carboxamide (CID 114756831) is 3-amino-N-[[1-(2-hydroxyethyl)cyclopropyl]methyl]oxolane-3-carboxamide.
What is the SMILES notation for 3-amino-N-[[1-(2-hydroxyethyl)cyclopropyl]methyl]oxolane-3-carboxamide?
The canonical SMILES for 3-amino-N-[[1-(2-hydroxyethyl)cyclopropyl]methyl]oxolane-3-carboxamide is NC1(C(=O)NCC2(CCO)CC2)CCOC1.
What is the InChIKey of 3-amino-N-[[1-(2-hydroxyethyl)cyclopropyl]methyl]oxolane-3-carboxamide?
The InChIKey is BOUCUZIIFBQADC-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H20N2O3/c12-11(4-6-16-8-11)9(15)13-7-10(1-2-10)3-5-14/h14H,1-8,12H2,(H,13,15).
What are the key properties of 3-amino-N-[[1-(2-hydroxyethyl)cyclopropyl]methyl]oxolane-3-carboxamide?
3-amino-N-[[1-(2-hydroxyethyl)cyclopropyl]methyl]oxolane-3-carboxamide has a molecular weight of 228.29 g/mol, XLogP of -0.62, 5 rotatable bonds, 3 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 3-amino-N-[[1-(2-hydroxyethyl)cyclopropyl]methyl]oxolane-3-carboxamide is sourced from PubChem (CID 114756831), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).