N-(4-amino-2-methoxyphenyl)-2-[cyclopropyl(methyl)amino]propanamide

C14H21N3O2 — CID 43264583

IUPACN-(4-amino-2-methoxyphenyl)-2-[cyclopropyl(methyl)amino]propanamide
SMILESCOc1cc(N)ccc1NC(=O)C(C)N(C)C1CC1
InChIInChI=1S/C14H21N3O2/c1-9(17(2)11-5-6-11)14(18)16-12-7-4-10(15)8-13(12)19-3/h4,7-9,11H,5-6,15H2,1-3H3,(H,16,18)
InChIKeyQINOTBXZSMUENI-UHFFFAOYSA-N
MW263.34 g/mol
LogP1.70
Rot. Bonds5

About N-(4-amino-2-methoxyphenyl)-2-[cyclopropyl(methyl)amino]propanamide

N-(4-amino-2-methoxyphenyl)-2-[cyclopropyl(methyl)amino]propanamide (PubChem CID 43264583) has the molecular formula C14H21N3O2 and a molecular weight of 263.34 g/mol. Its IUPAC name is N-(4-amino-2-methoxyphenyl)-2-[cyclopropyl(methyl)amino]propanamide.

Molecular Properties

Compound NameN-(4-amino-2-methoxyphenyl)-2-[cyclopropyl(methyl)amino]propanamide
PubChem CID43264583
Molecular FormulaC14H21N3O2
Molecular Weight263.34 g/mol
Exact Mass263.16
IUPAC NameN-(4-amino-2-methoxyphenyl)-2-[cyclopropyl(methyl)amino]propanamide
SMILESCOc1cc(N)ccc1NC(=O)C(C)N(C)C1CC1
InChIInChI=1S/C14H21N3O2/c1-9(17(2)11-5-6-11)14(18)16-12-7-4-10(15)8-13(12)19-3/h4,7-9,11H,5-6,15H2,1-3H3,(H,16,18)
InChIKeyQINOTBXZSMUENI-UHFFFAOYSA-N
XLogP1.70
TPSA67.59 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds5
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500263.34
LogP ≤ 51.70
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'aniline', 'substructure': 'N/A'}

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Related Compounds

N-(4-amino-2-methoxyphenyl)-2-[methyl(2-methylpropyl)amino]propanamide
CID 43271750
N-(4-amino-2-methoxyphenyl)-2-[(2-amino-2-oxoethyl)-methylamino]propanamide
CID 43373847
N-(4-amino-2-methoxyphenyl)-2-[2-cyanoethyl(methyl)amino]propanamide
CID 43186146
N-(4-amino-2-methoxyphenyl)-2-[2-ethoxyethyl(methyl)amino]propanamide
CID 81037444
N-(5-amino-2-methoxyphenyl)-2-[cyclopropylmethyl(methyl)amino]propanamide
CID 60984612
N-(2-amino-5-chlorophenyl)-2-[cyclopropyl(methyl)amino]propanamide
CID 43264543
N-(4-amino-2-methoxyphenyl)-2-(3,4-dimethylpyrrolidin-1-yl)propanamide
CID 79177188
N-(2-amino-4-chlorophenyl)-2-[cyclopentyl(methyl)amino]propanamide
CID 43266814
N-(4-amino-2-methoxyphenyl)-2-(cyclopentylmethoxy)propanamide
CID 66323873
N-(3-aminophenyl)-2-[cycloheptyl(methyl)amino]propanamide
CID 43613799
N-(4-amino-2-methoxyphenyl)-2-(4-methoxyphenoxy)propanamide
CID 54852607
N-(4-amino-2-methoxyphenyl)-2-(oxan-4-ylsulfanyl)propanamide
CID 62995880

Frequently Asked Questions

What is the IUPAC name of N-(4-amino-2-methoxyphenyl)-2-[cyclopropyl(methyl)amino]propanamide?
The IUPAC name of N-(4-amino-2-methoxyphenyl)-2-[cyclopropyl(methyl)amino]propanamide (CID 43264583) is N-(4-amino-2-methoxyphenyl)-2-[cyclopropyl(methyl)amino]propanamide.
What is the SMILES notation for N-(4-amino-2-methoxyphenyl)-2-[cyclopropyl(methyl)amino]propanamide?
The canonical SMILES for N-(4-amino-2-methoxyphenyl)-2-[cyclopropyl(methyl)amino]propanamide is COc1cc(N)ccc1NC(=O)C(C)N(C)C1CC1.
What is the InChIKey of N-(4-amino-2-methoxyphenyl)-2-[cyclopropyl(methyl)amino]propanamide?
The InChIKey is QINOTBXZSMUENI-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H21N3O2/c1-9(17(2)11-5-6-11)14(18)16-12-7-4-10(15)8-13(12)19-3/h4,7-9,11H,5-6,15H2,1-3H3,(H,16,18).
What are the key properties of N-(4-amino-2-methoxyphenyl)-2-[cyclopropyl(methyl)amino]propanamide?
N-(4-amino-2-methoxyphenyl)-2-[cyclopropyl(methyl)amino]propanamide has a molecular weight of 263.34 g/mol, XLogP of 1.70, 5 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-(4-amino-2-methoxyphenyl)-2-[cyclopropyl(methyl)amino]propanamide is sourced from PubChem (CID 43264583), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).