1-[2-(dimethylamino)ethylamino]cyclobutane-1-carboxamide

C9H19N3O — CID 60996759

IUPAC1-[2-(dimethylamino)ethylamino]cyclobutane-1-carboxamide
SMILESCN(C)CCNC1(C(N)=O)CCC1
InChIInChI=1S/C9H19N3O/c1-12(2)7-6-11-9(8(10)13)4-3-5-9/h11H,3-7H2,1-2H3,(H2,10,13)
InChIKeyQTYYFAYLXOOWNB-UHFFFAOYSA-N
MW185.27 g/mol
LogP-0.45
Rot. Bonds5

About 1-[2-(dimethylamino)ethylamino]cyclobutane-1-carboxamide

1-[2-(dimethylamino)ethylamino]cyclobutane-1-carboxamide (PubChem CID 60996759) has the molecular formula C9H19N3O and a molecular weight of 185.27 g/mol. Its IUPAC name is 1-[2-(dimethylamino)ethylamino]cyclobutane-1-carboxamide.

Molecular Properties

Compound Name1-[2-(dimethylamino)ethylamino]cyclobutane-1-carboxamide
PubChem CID60996759
Molecular FormulaC9H19N3O
Molecular Weight185.27 g/mol
Exact Mass185.15
IUPAC Name1-[2-(dimethylamino)ethylamino]cyclobutane-1-carboxamide
SMILESCN(C)CCNC1(C(N)=O)CCC1
InChIInChI=1S/C9H19N3O/c1-12(2)7-6-11-9(8(10)13)4-3-5-9/h11H,3-7H2,1-2H3,(H2,10,13)
InChIKeyQTYYFAYLXOOWNB-UHFFFAOYSA-N
XLogP-0.45
TPSA58.36 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds5
Heavy Atoms13
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500185.27
LogP ≤ 5-0.45
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Related Compounds

1-[2-(dimethylamino)ethylamino]-3,3-dimethylcyclopentane-1-carboxamide
CID 80705706
1-[2-(dimethylamino)ethylamino]-3-propan-2-ylcyclohexane-1-carboxamide
CID 107449317
1-[2-(diethylamino)ethylamino]cyclooctane-1-carboxamide
CID 61005401
1-[2-(diethylamino)ethylamino]cyclopropane-1-carboxamide
CID 104577737
3-[2-(dimethylamino)ethylamino]-1,5-dimethylpyrrolidine-3-carboxamide
CID 81468825
1-[2-(dimethylamino)ethylamino]-2-methylcyclopentane-1-carboxamide
CID 65045175
4-[2-(diethylamino)ethylamino]-1-methylazepane-4-carboxamide
CID 65074848
ethyl 4-[2-(dimethylamino)ethylamino]oxepane-4-carboxylate
CID 65079017
6-bromo-2-[2-(dimethylamino)ethylamino]-3,4-dihydro-1H-naphthalene-2-carboxamide
CID 63630990
4-[2-(diethylamino)ethylamino]oxane-4-carboxamide
CID 61004988
methyl 1-[2-(dimethylamino)ethylamino]-4-methylcycloheptane-1-carboxylate
CID 65085158
methyl 1-[2-(dimethylamino)ethylamino]-3-methylcyclohexane-1-carboxylate
CID 54895132

Frequently Asked Questions

What is the IUPAC name of 1-[2-(dimethylamino)ethylamino]cyclobutane-1-carboxamide?
The IUPAC name of 1-[2-(dimethylamino)ethylamino]cyclobutane-1-carboxamide (CID 60996759) is 1-[2-(dimethylamino)ethylamino]cyclobutane-1-carboxamide.
What is the SMILES notation for 1-[2-(dimethylamino)ethylamino]cyclobutane-1-carboxamide?
The canonical SMILES for 1-[2-(dimethylamino)ethylamino]cyclobutane-1-carboxamide is CN(C)CCNC1(C(N)=O)CCC1.
What is the InChIKey of 1-[2-(dimethylamino)ethylamino]cyclobutane-1-carboxamide?
The InChIKey is QTYYFAYLXOOWNB-UHFFFAOYSA-N. The full InChI is InChI=1S/C9H19N3O/c1-12(2)7-6-11-9(8(10)13)4-3-5-9/h11H,3-7H2,1-2H3,(H2,10,13).
What are the key properties of 1-[2-(dimethylamino)ethylamino]cyclobutane-1-carboxamide?
1-[2-(dimethylamino)ethylamino]cyclobutane-1-carboxamide has a molecular weight of 185.27 g/mol, XLogP of -0.45, 5 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 1-[2-(dimethylamino)ethylamino]cyclobutane-1-carboxamide is sourced from PubChem (CID 60996759), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).