1-amino-N-[3-[2-(dimethylamino)ethoxy]phenyl]cyclopropane-1-carboxamide

C14H21N3O2 — CID 65464434

IUPAC1-amino-N-[3-[2-(dimethylamino)ethoxy]phenyl]cyclopropane-1-carboxamide
SMILESCN(C)CCOc1cccc(NC(=O)C2(N)CC2)c1
InChIInChI=1S/C14H21N3O2/c1-17(2)8-9-19-12-5-3-4-11(10-12)16-13(18)14(15)6-7-14/h3-5,10H,6-9,15H2,1-2H3,(H,16,18)
InChIKeyFGAGVDMNBATMEM-UHFFFAOYSA-N
MW263.34 g/mol
LogP1.06
Rot. Bonds6

About 1-amino-N-[3-[2-(dimethylamino)ethoxy]phenyl]cyclopropane-1-carboxamide

1-amino-N-[3-[2-(dimethylamino)ethoxy]phenyl]cyclopropane-1-carboxamide (PubChem CID 65464434) has the molecular formula C14H21N3O2 and a molecular weight of 263.34 g/mol. Its IUPAC name is 1-amino-N-[3-[2-(dimethylamino)ethoxy]phenyl]cyclopropane-1-carboxamide.

Molecular Properties

Compound Name1-amino-N-[3-[2-(dimethylamino)ethoxy]phenyl]cyclopropane-1-carboxamide
PubChem CID65464434
Molecular FormulaC14H21N3O2
Molecular Weight263.34 g/mol
Exact Mass263.16
IUPAC Name1-amino-N-[3-[2-(dimethylamino)ethoxy]phenyl]cyclopropane-1-carboxamide
SMILESCN(C)CCOc1cccc(NC(=O)C2(N)CC2)c1
InChIInChI=1S/C14H21N3O2/c1-17(2)8-9-19-12-5-3-4-11(10-12)16-13(18)14(15)6-7-14/h3-5,10H,6-9,15H2,1-2H3,(H,16,18)
InChIKeyFGAGVDMNBATMEM-UHFFFAOYSA-N
XLogP1.06
TPSA67.59 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds6
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500263.34
LogP ≤ 51.06
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

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Related Compounds

1-(aminomethyl)-N-[3-[2-(dimethylamino)ethoxy]phenyl]cyclopentane-1-carboxamide;dihydrochloride
CID 119844438
N-[3-[2-(dimethylamino)ethoxy]phenyl]-4-methoxypiperidine-4-carboxamide
CID 119844483
1-amino-N-[3-(2-methylpropoxy)phenyl]cyclopropane-1-carboxamide;hydrochloride
CID 119714874
1-amino-N-[3-(2-amino-2-oxoethoxy)phenyl]cyclopropane-1-carboxamide;hydrochloride
CID 119702073
N-[3-[2-(dimethylamino)ethoxy]phenyl]-2,2-dimethylpropanamide
CID 60776296
N-[3-[2-(dimethylamino)ethoxy]phenyl]butanamide
CID 60776294
N-[3-[3-(dimethylamino)propoxy]phenyl]acetamide
CID 71811695
1-amino-N-[3-(2-amino-2-oxoethoxy)phenyl]cyclopentane-1-carboxamide
CID 60852261
2-[3-[(1-aminocyclobutanecarbonyl)amino]phenoxy]acetic acid
CID 81169639
(2S)-2-amino-N-[3-[2-(dimethylamino)ethoxy]phenyl]-3,3-dimethylbutanamide
CID 61180242
2,2,2-trifluoroethyl N-[3-[2-(dimethylamino)ethoxy]phenyl]carbamate
CID 65173309
3-amino-4-[3-[2-(dimethylamino)ethoxy]anilino]-4-oxobutanoic acid
CID 64897056

Frequently Asked Questions

What is the IUPAC name of 1-amino-N-[3-[2-(dimethylamino)ethoxy]phenyl]cyclopropane-1-carboxamide?
The IUPAC name of 1-amino-N-[3-[2-(dimethylamino)ethoxy]phenyl]cyclopropane-1-carboxamide (CID 65464434) is 1-amino-N-[3-[2-(dimethylamino)ethoxy]phenyl]cyclopropane-1-carboxamide.
What is the SMILES notation for 1-amino-N-[3-[2-(dimethylamino)ethoxy]phenyl]cyclopropane-1-carboxamide?
The canonical SMILES for 1-amino-N-[3-[2-(dimethylamino)ethoxy]phenyl]cyclopropane-1-carboxamide is CN(C)CCOc1cccc(NC(=O)C2(N)CC2)c1.
What is the InChIKey of 1-amino-N-[3-[2-(dimethylamino)ethoxy]phenyl]cyclopropane-1-carboxamide?
The InChIKey is FGAGVDMNBATMEM-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H21N3O2/c1-17(2)8-9-19-12-5-3-4-11(10-12)16-13(18)14(15)6-7-14/h3-5,10H,6-9,15H2,1-2H3,(H,16,18).
What are the key properties of 1-amino-N-[3-[2-(dimethylamino)ethoxy]phenyl]cyclopropane-1-carboxamide?
1-amino-N-[3-[2-(dimethylamino)ethoxy]phenyl]cyclopropane-1-carboxamide has a molecular weight of 263.34 g/mol, XLogP of 1.06, 6 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 1-amino-N-[3-[2-(dimethylamino)ethoxy]phenyl]cyclopropane-1-carboxamide is sourced from PubChem (CID 65464434), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).