N-(3-aminopropyl)-N-ethyl-2-methylcyclopropane-1-carboxamide

C10H20N2O — CID 43136497

IUPACN-(3-aminopropyl)-N-ethyl-2-methylcyclopropane-1-carboxamide
SMILESCCN(CCCN)C(=O)C1CC1C
InChIInChI=1S/C10H20N2O/c1-3-12(6-4-5-11)10(13)9-7-8(9)2/h8-9H,3-7,11H2,1-2H3
InChIKeyYGTMYYKDEHYKSQ-UHFFFAOYSA-N
MW184.28 g/mol
LogP0.84
Rot. Bonds5

About N-(3-aminopropyl)-N-ethyl-2-methylcyclopropane-1-carboxamide

N-(3-aminopropyl)-N-ethyl-2-methylcyclopropane-1-carboxamide (PubChem CID 43136497) has the molecular formula C10H20N2O and a molecular weight of 184.28 g/mol. Its IUPAC name is N-(3-aminopropyl)-N-ethyl-2-methylcyclopropane-1-carboxamide.

Molecular Properties

Compound NameN-(3-aminopropyl)-N-ethyl-2-methylcyclopropane-1-carboxamide
PubChem CID43136497
Molecular FormulaC10H20N2O
Molecular Weight184.28 g/mol
Exact Mass184.16
IUPAC NameN-(3-aminopropyl)-N-ethyl-2-methylcyclopropane-1-carboxamide
SMILESCCN(CCCN)C(=O)C1CC1C
InChIInChI=1S/C10H20N2O/c1-3-12(6-4-5-11)10(13)9-7-8(9)2/h8-9H,3-7,11H2,1-2H3
InChIKeyYGTMYYKDEHYKSQ-UHFFFAOYSA-N
XLogP0.84
TPSA46.33 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds5
Heavy Atoms13
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500184.28
LogP ≤ 50.84
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Related Compounds

cis-(1R,2S)-N,N-diethyl-2-methylcyclopropane-1-carboxamide
CID 121226955
N-(3-aminopropyl)-2-methyl-N-propan-2-ylcyclopropane-1-carboxamide
CID 43136679
N-(3-aminopropyl)-2-methyl-N-propyloxolane-3-carboxamide
CID 79750666
2-[3-(dimethylamino)propyl-ethylcarbamoyl]-4-methylcyclopentane-1-carboxylic acid
CID 102991709
N-(3-aminopropyl)-N-propylbicyclo[2.2.1]heptane-2-carboxamide
CID 61363750
N-(2-aminoethyl)-N-cyclopropyl-2-methylcyclopropane-1-carboxamide
CID 61350134
2-[butyl(ethyl)carbamoyl]-4-ethylcyclopentane-1-carboxylic acid
CID 114511258
5-chloro-N,N-diethyl-2-methylcyclohexane-1-carboxamide
CID 86118726
1-(3-aminopropyl)-1-cyclopropyl-3,3-diethylurea
CID 79154786
N-(3-aminopropyl)-N-ethylbicyclo[4.2.0]octa-1,3,5-triene-7-carboxamide
CID 66396266
4-amino-N-butyl-N-ethyl-3-methylcyclohexane-1-carboxamide
CID 62781326
5-amino-N-butyl-N-(2-hydroxyethyl)-2,4-dimethylcyclohexane-1-carboxamide
CID 102706594

Frequently Asked Questions

What is the IUPAC name of N-(3-aminopropyl)-N-ethyl-2-methylcyclopropane-1-carboxamide?
The IUPAC name of N-(3-aminopropyl)-N-ethyl-2-methylcyclopropane-1-carboxamide (CID 43136497) is N-(3-aminopropyl)-N-ethyl-2-methylcyclopropane-1-carboxamide.
What is the SMILES notation for N-(3-aminopropyl)-N-ethyl-2-methylcyclopropane-1-carboxamide?
The canonical SMILES for N-(3-aminopropyl)-N-ethyl-2-methylcyclopropane-1-carboxamide is CCN(CCCN)C(=O)C1CC1C.
What is the InChIKey of N-(3-aminopropyl)-N-ethyl-2-methylcyclopropane-1-carboxamide?
The InChIKey is YGTMYYKDEHYKSQ-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H20N2O/c1-3-12(6-4-5-11)10(13)9-7-8(9)2/h8-9H,3-7,11H2,1-2H3.
What are the key properties of N-(3-aminopropyl)-N-ethyl-2-methylcyclopropane-1-carboxamide?
N-(3-aminopropyl)-N-ethyl-2-methylcyclopropane-1-carboxamide has a molecular weight of 184.28 g/mol, XLogP of 0.84, 5 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N-(3-aminopropyl)-N-ethyl-2-methylcyclopropane-1-carboxamide is sourced from PubChem (CID 43136497), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).