N-[4-(aminomethyl)phenyl]-N-cyclopropyl-2-(1-methoxycyclobutyl)acetamide

C17H24N2O2 — CID 103555309

IUPACN-[4-(aminomethyl)phenyl]-N-cyclopropyl-2-(1-methoxycyclobutyl)acetamide
SMILESCOC1(CC(=O)N(c2ccc(CN)cc2)C2CC2)CCC1
InChIInChI=1S/C17H24N2O2/c1-21-17(9-2-10-17)11-16(20)19(15-7-8-15)14-5-3-13(12-18)4-6-14/h3-6,15H,2,7-12,18H2,1H3
InChIKeyRVWQGFVOIARQGF-UHFFFAOYSA-N
MW288.39 g/mol
LogP2.60
Rot. Bonds6

About N-[4-(aminomethyl)phenyl]-N-cyclopropyl-2-(1-methoxycyclobutyl)acetamide

N-[4-(aminomethyl)phenyl]-N-cyclopropyl-2-(1-methoxycyclobutyl)acetamide (PubChem CID 103555309) has the molecular formula C17H24N2O2 and a molecular weight of 288.39 g/mol. Its IUPAC name is N-[4-(aminomethyl)phenyl]-N-cyclopropyl-2-(1-methoxycyclobutyl)acetamide.

Molecular Properties

Compound NameN-[4-(aminomethyl)phenyl]-N-cyclopropyl-2-(1-methoxycyclobutyl)acetamide
PubChem CID103555309
Molecular FormulaC17H24N2O2
Molecular Weight288.39 g/mol
Exact Mass288.18
IUPAC NameN-[4-(aminomethyl)phenyl]-N-cyclopropyl-2-(1-methoxycyclobutyl)acetamide
SMILESCOC1(CC(=O)N(c2ccc(CN)cc2)C2CC2)CCC1
InChIInChI=1S/C17H24N2O2/c1-21-17(9-2-10-17)11-16(20)19(15-7-8-15)14-5-3-13(12-18)4-6-14/h3-6,15H,2,7-12,18H2,1H3
InChIKeyRVWQGFVOIARQGF-UHFFFAOYSA-N
XLogP2.60
TPSA55.56 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds6
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500288.39
LogP ≤ 52.60
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

N-[4-(aminomethyl)phenyl]-N-cyclopropyl-2-ethoxyacetamide
CID 43276024
ethyl N-[4-(aminomethyl)phenyl]-N-cyclopropylcarbamate
CID 43276107
N-[4-(aminomethyl)phenyl]-N-cyclopropyl-2-(2,2,2-trifluoroethoxy)acetamide
CID 103205396
phenyl N-[4-(aminomethyl)phenyl]-N-cyclopropylcarbamate
CID 43276104
N-[4-(aminomethyl)phenyl]-N-cyclopropyloxolane-2-carboxamide
CID 43276045
N-[4-(aminomethyl)phenyl]-N-cyclopropyl-6-methylpyridine-2-carboxamide
CID 43276034
N-benzyl-N-(2-chloroethyl)-2-(1-methoxycyclobutyl)acetamide
CID 103558164
N-(2-cyanoethyl)-N-cyclopropyl-2-(1-methoxycyclobutyl)acetamide
CID 103520343
N-[4-(aminomethyl)phenyl]-N-cyclopropyloxolane-3-carboxamide
CID 61271794
N-[(3-bromophenyl)methyl]-2-(1-methoxycyclobutyl)-N-methylacetamide
CID 103520091
N-[4-(aminomethyl)phenyl]-N-cyclopropyl-1-methylimidazole-4-carboxamide
CID 107970828
N-[4-(aminomethyl)phenyl]-N-cyclopropylpyridine-2-carboxamide
CID 43276062

Frequently Asked Questions

What is the IUPAC name of N-[4-(aminomethyl)phenyl]-N-cyclopropyl-2-(1-methoxycyclobutyl)acetamide?
The IUPAC name of N-[4-(aminomethyl)phenyl]-N-cyclopropyl-2-(1-methoxycyclobutyl)acetamide (CID 103555309) is N-[4-(aminomethyl)phenyl]-N-cyclopropyl-2-(1-methoxycyclobutyl)acetamide.
What is the SMILES notation for N-[4-(aminomethyl)phenyl]-N-cyclopropyl-2-(1-methoxycyclobutyl)acetamide?
The canonical SMILES for N-[4-(aminomethyl)phenyl]-N-cyclopropyl-2-(1-methoxycyclobutyl)acetamide is COC1(CC(=O)N(c2ccc(CN)cc2)C2CC2)CCC1.
What is the InChIKey of N-[4-(aminomethyl)phenyl]-N-cyclopropyl-2-(1-methoxycyclobutyl)acetamide?
The InChIKey is RVWQGFVOIARQGF-UHFFFAOYSA-N. The full InChI is InChI=1S/C17H24N2O2/c1-21-17(9-2-10-17)11-16(20)19(15-7-8-15)14-5-3-13(12-18)4-6-14/h3-6,15H,2,7-12,18H2,1H3.
What are the key properties of N-[4-(aminomethyl)phenyl]-N-cyclopropyl-2-(1-methoxycyclobutyl)acetamide?
N-[4-(aminomethyl)phenyl]-N-cyclopropyl-2-(1-methoxycyclobutyl)acetamide has a molecular weight of 288.39 g/mol, XLogP of 2.60, 6 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-[4-(aminomethyl)phenyl]-N-cyclopropyl-2-(1-methoxycyclobutyl)acetamide is sourced from PubChem (CID 103555309), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).