1-(aminomethyl)-N-[2-(ethylamino)-2-oxoethyl]cyclopropane-1-carboxamide

C9H17N3O2 — CID 80587776

IUPAC1-(aminomethyl)-N-[2-(ethylamino)-2-oxoethyl]cyclopropane-1-carboxamide
SMILESCCNC(=O)CNC(=O)C1(CN)CC1
InChIInChI=1S/C9H17N3O2/c1-2-11-7(13)5-12-8(14)9(6-10)3-4-9/h2-6,10H2,1H3,(H,11,13)(H,12,14)
InChIKeyYMOUGIXMWCIUJO-UHFFFAOYSA-N
MW199.25 g/mol
LogP-1.02
Rot. Bonds5

About 1-(aminomethyl)-N-[2-(ethylamino)-2-oxoethyl]cyclopropane-1-carboxamide

1-(aminomethyl)-N-[2-(ethylamino)-2-oxoethyl]cyclopropane-1-carboxamide (PubChem CID 80587776) has the molecular formula C9H17N3O2 and a molecular weight of 199.25 g/mol. Its IUPAC name is 1-(aminomethyl)-N-[2-(ethylamino)-2-oxoethyl]cyclopropane-1-carboxamide.

Molecular Properties

Compound Name1-(aminomethyl)-N-[2-(ethylamino)-2-oxoethyl]cyclopropane-1-carboxamide
PubChem CID80587776
Molecular FormulaC9H17N3O2
Molecular Weight199.25 g/mol
Exact Mass199.13
IUPAC Name1-(aminomethyl)-N-[2-(ethylamino)-2-oxoethyl]cyclopropane-1-carboxamide
SMILESCCNC(=O)CNC(=O)C1(CN)CC1
InChIInChI=1S/C9H17N3O2/c1-2-11-7(13)5-12-8(14)9(6-10)3-4-9/h2-6,10H2,1H3,(H,11,13)(H,12,14)
InChIKeyYMOUGIXMWCIUJO-UHFFFAOYSA-N
XLogP-1.02
TPSA84.22 Ų
H-Bond Donors3
H-Bond Acceptors3
Rotatable Bonds5
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500199.25
LogP ≤ 5-1.02
H-Bond Donors ≤ 53
H-Bond Acceptors ≤ 103

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Related Compounds

1-(aminomethyl)-N-[2-oxo-2-(propan-2-ylamino)ethyl]cyclobutane-1-carboxamide
CID 80588209
1-(2-aminoethyl)-N-ethylcyclopentane-1-carboxamide
CID 166106109
2-[[1-(aminomethyl)cyclohexanecarbonyl]amino]acetic acid
CID 115437637
1-(aminomethyl)-N-[2-(dimethylamino)-2-oxoethyl]cyclobutane-1-carboxamide
CID 80588092
1-(aminomethyl)-N-[2-(dimethylamino)propyl]cyclopropane-1-carboxamide
CID 80587365
1-(aminomethyl)-N-ethoxycyclopropane-1-carboxamide
CID 115453415
1-cyano-N-[2-(ethylamino)-2-oxoethyl]cyclohexane-1-carboxamide
CID 61461650
1-(aminomethyl)-N-(2,2,2-trifluoroethyl)cyclopropane-1-carboxamide
CID 80587530
1-(aminomethyl)-N-(2,2,3,3-tetramethylcyclopropyl)cyclopropane-1-carboxamide
CID 80597965
1-(aminomethyl)-N-(3-amino-3-oxopropyl)cyclopropane-1-carboxamide
CID 80588317
1-(aminomethyl)-N-(2-methoxy-2-methylpropyl)cyclopropane-1-carboxamide
CID 104759874
4-[[1-(aminomethyl)cyclopropanecarbonyl]amino]-N-ethylbenzamide
CID 115452592

Frequently Asked Questions

What is the IUPAC name of 1-(aminomethyl)-N-[2-(ethylamino)-2-oxoethyl]cyclopropane-1-carboxamide?
The IUPAC name of 1-(aminomethyl)-N-[2-(ethylamino)-2-oxoethyl]cyclopropane-1-carboxamide (CID 80587776) is 1-(aminomethyl)-N-[2-(ethylamino)-2-oxoethyl]cyclopropane-1-carboxamide.
What is the SMILES notation for 1-(aminomethyl)-N-[2-(ethylamino)-2-oxoethyl]cyclopropane-1-carboxamide?
The canonical SMILES for 1-(aminomethyl)-N-[2-(ethylamino)-2-oxoethyl]cyclopropane-1-carboxamide is CCNC(=O)CNC(=O)C1(CN)CC1.
What is the InChIKey of 1-(aminomethyl)-N-[2-(ethylamino)-2-oxoethyl]cyclopropane-1-carboxamide?
The InChIKey is YMOUGIXMWCIUJO-UHFFFAOYSA-N. The full InChI is InChI=1S/C9H17N3O2/c1-2-11-7(13)5-12-8(14)9(6-10)3-4-9/h2-6,10H2,1H3,(H,11,13)(H,12,14).
What are the key properties of 1-(aminomethyl)-N-[2-(ethylamino)-2-oxoethyl]cyclopropane-1-carboxamide?
1-(aminomethyl)-N-[2-(ethylamino)-2-oxoethyl]cyclopropane-1-carboxamide has a molecular weight of 199.25 g/mol, XLogP of -1.02, 5 rotatable bonds, 3 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 1-(aminomethyl)-N-[2-(ethylamino)-2-oxoethyl]cyclopropane-1-carboxamide is sourced from PubChem (CID 80587776), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).