1-amino-N-(2-hydroxyethyl)-N-propylcyclopropane-1-carboxamide

C9H18N2O2 — CID 65466619

IUPAC1-amino-N-(2-hydroxyethyl)-N-propylcyclopropane-1-carboxamide
SMILESCCCN(CCO)C(=O)C1(N)CC1
InChIInChI=1S/C9H18N2O2/c1-2-5-11(6-7-12)8(13)9(10)3-4-9/h12H,2-7,10H2,1H3
InChIKeyJLEVLUREBYQTJI-UHFFFAOYSA-N
MW186.25 g/mol
LogP-0.29
Rot. Bonds5

About 1-amino-N-(2-hydroxyethyl)-N-propylcyclopropane-1-carboxamide

1-amino-N-(2-hydroxyethyl)-N-propylcyclopropane-1-carboxamide (PubChem CID 65466619) has the molecular formula C9H18N2O2 and a molecular weight of 186.25 g/mol. Its IUPAC name is 1-amino-N-(2-hydroxyethyl)-N-propylcyclopropane-1-carboxamide.

Molecular Properties

Compound Name1-amino-N-(2-hydroxyethyl)-N-propylcyclopropane-1-carboxamide
PubChem CID65466619
Molecular FormulaC9H18N2O2
Molecular Weight186.25 g/mol
Exact Mass186.14
IUPAC Name1-amino-N-(2-hydroxyethyl)-N-propylcyclopropane-1-carboxamide
SMILESCCCN(CCO)C(=O)C1(N)CC1
InChIInChI=1S/C9H18N2O2/c1-2-5-11(6-7-12)8(13)9(10)3-4-9/h12H,2-7,10H2,1H3
InChIKeyJLEVLUREBYQTJI-UHFFFAOYSA-N
XLogP-0.29
TPSA66.56 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds5
Heavy Atoms13
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500186.25
LogP ≤ 5-0.29
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of 1-amino-N-(2-hydroxyethyl)-N-propylcyclopropane-1-carboxamide?
The IUPAC name of 1-amino-N-(2-hydroxyethyl)-N-propylcyclopropane-1-carboxamide (CID 65466619) is 1-amino-N-(2-hydroxyethyl)-N-propylcyclopropane-1-carboxamide.
What is the SMILES notation for 1-amino-N-(2-hydroxyethyl)-N-propylcyclopropane-1-carboxamide?
The canonical SMILES for 1-amino-N-(2-hydroxyethyl)-N-propylcyclopropane-1-carboxamide is CCCN(CCO)C(=O)C1(N)CC1.
What is the InChIKey of 1-amino-N-(2-hydroxyethyl)-N-propylcyclopropane-1-carboxamide?
The InChIKey is JLEVLUREBYQTJI-UHFFFAOYSA-N. The full InChI is InChI=1S/C9H18N2O2/c1-2-5-11(6-7-12)8(13)9(10)3-4-9/h12H,2-7,10H2,1H3.
What are the key properties of 1-amino-N-(2-hydroxyethyl)-N-propylcyclopropane-1-carboxamide?
1-amino-N-(2-hydroxyethyl)-N-propylcyclopropane-1-carboxamide has a molecular weight of 186.25 g/mol, XLogP of -0.29, 5 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 1-amino-N-(2-hydroxyethyl)-N-propylcyclopropane-1-carboxamide is sourced from PubChem (CID 65466619), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).