N-methyl-4-[[(2,2,3,3-tetramethylcyclopropyl)amino]methyl]benzamide

C16H24N2O — CID 79358376

IUPACN-methyl-4-[[(2,2,3,3-tetramethylcyclopropyl)amino]methyl]benzamide
SMILESCNC(=O)c1ccc(CNC2C(C)(C)C2(C)C)cc1
InChIInChI=1S/C16H24N2O/c1-15(2)14(16(15,3)4)18-10-11-6-8-12(9-7-11)13(19)17-5/h6-9,14,18H,10H2,1-5H3,(H,17,19)
InChIKeyAPFFBZGJQLVDLV-UHFFFAOYSA-N
MW260.38 g/mol
LogP2.57
Rot. Bonds4

About N-methyl-4-[[(2,2,3,3-tetramethylcyclopropyl)amino]methyl]benzamide

N-methyl-4-[[(2,2,3,3-tetramethylcyclopropyl)amino]methyl]benzamide (PubChem CID 79358376) has the molecular formula C16H24N2O and a molecular weight of 260.38 g/mol. Its IUPAC name is N-methyl-4-[[(2,2,3,3-tetramethylcyclopropyl)amino]methyl]benzamide.

Molecular Properties

Compound NameN-methyl-4-[[(2,2,3,3-tetramethylcyclopropyl)amino]methyl]benzamide
PubChem CID79358376
Molecular FormulaC16H24N2O
Molecular Weight260.38 g/mol
Exact Mass260.19
IUPAC NameN-methyl-4-[[(2,2,3,3-tetramethylcyclopropyl)amino]methyl]benzamide
SMILESCNC(=O)c1ccc(CNC2C(C)(C)C2(C)C)cc1
InChIInChI=1S/C16H24N2O/c1-15(2)14(16(15,3)4)18-10-11-6-8-12(9-7-11)13(19)17-5/h6-9,14,18H,10H2,1-5H3,(H,17,19)
InChIKeyAPFFBZGJQLVDLV-UHFFFAOYSA-N
XLogP2.57
TPSA41.13 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds4
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500260.38
LogP ≤ 52.57
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 102

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Related Compounds

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CID 104588896
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CID 78849595
4-[(carbamoylamino)methyl]-N-methylbenzamide
CID 39969427
N-methyl-4-[(thian-4-ylamino)methyl]benzamide
CID 43329353
4-[[(5,5-dimethylthian-3-yl)amino]methyl]-N-methylbenzamide
CID 79955054
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CID 153377467
4-[[(1,1-dioxothian-4-yl)amino]methyl]-N-methylbenzamide
CID 43511571
4-[[(3-aminocyclopentyl)amino]methyl]-N-methylbenzamide
CID 79462597
4-[[(3-ethoxycyclobutyl)amino]methyl]-N-methylbenzamide
CID 112553050
4-[[(1-ethylpiperidin-4-yl)amino]methyl]-N-methylbenzamide
CID 28620099
N-methyl-4-[(propan-2-ylcarbamoylamino)methyl]benzamide
CID 47116390
5-[[[4-(methylcarbamoyl)phenyl]methylamino]methyl]furan-2-carboxylic acid
CID 63316587

Frequently Asked Questions

What is the IUPAC name of N-methyl-4-[[(2,2,3,3-tetramethylcyclopropyl)amino]methyl]benzamide?
The IUPAC name of N-methyl-4-[[(2,2,3,3-tetramethylcyclopropyl)amino]methyl]benzamide (CID 79358376) is N-methyl-4-[[(2,2,3,3-tetramethylcyclopropyl)amino]methyl]benzamide.
What is the SMILES notation for N-methyl-4-[[(2,2,3,3-tetramethylcyclopropyl)amino]methyl]benzamide?
The canonical SMILES for N-methyl-4-[[(2,2,3,3-tetramethylcyclopropyl)amino]methyl]benzamide is CNC(=O)c1ccc(CNC2C(C)(C)C2(C)C)cc1.
What is the InChIKey of N-methyl-4-[[(2,2,3,3-tetramethylcyclopropyl)amino]methyl]benzamide?
The InChIKey is APFFBZGJQLVDLV-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H24N2O/c1-15(2)14(16(15,3)4)18-10-11-6-8-12(9-7-11)13(19)17-5/h6-9,14,18H,10H2,1-5H3,(H,17,19).
What are the key properties of N-methyl-4-[[(2,2,3,3-tetramethylcyclopropyl)amino]methyl]benzamide?
N-methyl-4-[[(2,2,3,3-tetramethylcyclopropyl)amino]methyl]benzamide has a molecular weight of 260.38 g/mol, XLogP of 2.57, 4 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N-methyl-4-[[(2,2,3,3-tetramethylcyclopropyl)amino]methyl]benzamide is sourced from PubChem (CID 79358376), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).