N-(1-aminohexan-2-yl)-2-ethoxycyclopropane-1-carboxamide;hydrochloride

C12H25ClN2O2 — CID 119668699

IUPACN-(1-aminohexan-2-yl)-2-ethoxycyclopropane-1-carboxamide;hydrochloride
SMILESCCCCC(CN)NC(=O)C1CC1OCC.Cl
InChIInChI=1S/C12H24N2O2.ClH/c1-3-5-6-9(8-13)14-12(15)10-7-11(10)16-4-2;/h9-11H,3-8,13H2,1-2H3,(H,14,15);1H
InChIKeyRYRORYUBTNLELV-UHFFFAOYSA-N
MW264.80 g/mol
LogP1.47
Rot. Bonds8

About N-(1-aminohexan-2-yl)-2-ethoxycyclopropane-1-carboxamide;hydrochloride

N-(1-aminohexan-2-yl)-2-ethoxycyclopropane-1-carboxamide;hydrochloride (PubChem CID 119668699) has the molecular formula C12H25ClN2O2 and a molecular weight of 264.80 g/mol. Its IUPAC name is N-(1-aminohexan-2-yl)-2-ethoxycyclopropane-1-carboxamide;hydrochloride.

Molecular Properties

Compound NameN-(1-aminohexan-2-yl)-2-ethoxycyclopropane-1-carboxamide;hydrochloride
PubChem CID119668699
Molecular FormulaC12H25ClN2O2
Molecular Weight264.80 g/mol
Exact Mass264.16
IUPAC NameN-(1-aminohexan-2-yl)-2-ethoxycyclopropane-1-carboxamide;hydrochloride
SMILESCCCCC(CN)NC(=O)C1CC1OCC.Cl
InChIInChI=1S/C12H24N2O2.ClH/c1-3-5-6-9(8-13)14-12(15)10-7-11(10)16-4-2;/h9-11H,3-8,13H2,1-2H3,(H,14,15);1H
InChIKeyRYRORYUBTNLELV-UHFFFAOYSA-N
XLogP1.47
TPSA64.35 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds8
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500264.80
LogP ≤ 51.47
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Related Compounds

(2S)-2-[(2-ethoxycyclopropanecarbonyl)amino]hexanoic acid
CID 120614297
N-(1-aminohexan-2-yl)cyclohexanecarboxamide
CID 80697500
N-(1-aminohexan-2-yl)-2-(2-methylphenyl)cyclopropane-1-carboxamide;hydrochloride
CID 119667796
N-(1-aminohexan-2-yl)-1-ethyl-5-oxopyrrolidine-3-carboxamide
CID 119668568
N-(1-aminohexan-2-yl)-2-(3,4-difluorophenyl)cyclopropane-1-carboxamide
CID 119667750
N-(1-aminohexan-2-yl)thiolane-2-carboxamide
CID 80698105
N-(1-amino-2-methylpropan-2-yl)-2-ethoxycyclopropane-1-carboxamide
CID 119525062
N-(1-aminohexan-2-yl)-2-[(2-methylpropan-2-yl)oxy]acetamide
CID 112603533
N-(1-aminohexan-2-yl)-2-(cyclopropylmethylamino)acetamide
CID 122080965
N-(1-aminohexan-2-yl)-1-(4-methylcyclohexyl)-5-oxopyrrolidine-3-carboxamide
CID 119665181
N-(1-aminohexan-2-yl)-1-methyl-2-(1-methylpyrazol-4-yl)-6-oxopiperidine-3-carboxamide;dihydrochloride
CID 119668820
3-(1-aminohexan-2-yl)-1,1-dimethylurea
CID 80697976

Frequently Asked Questions

What is the IUPAC name of N-(1-aminohexan-2-yl)-2-ethoxycyclopropane-1-carboxamide;hydrochloride?
The IUPAC name of N-(1-aminohexan-2-yl)-2-ethoxycyclopropane-1-carboxamide;hydrochloride (CID 119668699) is N-(1-aminohexan-2-yl)-2-ethoxycyclopropane-1-carboxamide;hydrochloride.
What is the SMILES notation for N-(1-aminohexan-2-yl)-2-ethoxycyclopropane-1-carboxamide;hydrochloride?
The canonical SMILES for N-(1-aminohexan-2-yl)-2-ethoxycyclopropane-1-carboxamide;hydrochloride is CCCCC(CN)NC(=O)C1CC1OCC.Cl.
What is the InChIKey of N-(1-aminohexan-2-yl)-2-ethoxycyclopropane-1-carboxamide;hydrochloride?
The InChIKey is RYRORYUBTNLELV-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H24N2O2.ClH/c1-3-5-6-9(8-13)14-12(15)10-7-11(10)16-4-2;/h9-11H,3-8,13H2,1-2H3,(H,14,15);1H.
What are the key properties of N-(1-aminohexan-2-yl)-2-ethoxycyclopropane-1-carboxamide;hydrochloride?
N-(1-aminohexan-2-yl)-2-ethoxycyclopropane-1-carboxamide;hydrochloride has a molecular weight of 264.80 g/mol, XLogP of 1.47, 8 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-(1-aminohexan-2-yl)-2-ethoxycyclopropane-1-carboxamide;hydrochloride is sourced from PubChem (CID 119668699), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).