N-(3-methoxy-2,2,3-trimethylcyclobutyl)-N,2-dimethyl-3-(methylamino)propanamide;hydrochloride

C14H29ClN2O2 — CID 119817564

IUPACN-(3-methoxy-2,2,3-trimethylcyclobutyl)-N,2-dimethyl-3-(methylamino)propanamide;hydrochloride
SMILESCNCC(C)C(=O)N(C)C1CC(C)(OC)C1(C)C.Cl
InChIInChI=1S/C14H28N2O2.ClH/c1-10(9-15-5)12(17)16(6)11-8-14(4,18-7)13(11,2)3;/h10-11,15H,8-9H2,1-7H3;1H
InChIKeyKEMXNTVVRRMGKA-UHFFFAOYSA-N
MW292.85 g/mol
LogP1.93
Rot. Bonds5

About N-(3-methoxy-2,2,3-trimethylcyclobutyl)-N,2-dimethyl-3-(methylamino)propanamide;hydrochloride

N-(3-methoxy-2,2,3-trimethylcyclobutyl)-N,2-dimethyl-3-(methylamino)propanamide;hydrochloride (PubChem CID 119817564) has the molecular formula C14H29ClN2O2 and a molecular weight of 292.85 g/mol. Its IUPAC name is N-(3-methoxy-2,2,3-trimethylcyclobutyl)-N,2-dimethyl-3-(methylamino)propanamide;hydrochloride.

Molecular Properties

Compound NameN-(3-methoxy-2,2,3-trimethylcyclobutyl)-N,2-dimethyl-3-(methylamino)propanamide;hydrochloride
PubChem CID119817564
Molecular FormulaC14H29ClN2O2
Molecular Weight292.85 g/mol
Exact Mass292.19
IUPAC NameN-(3-methoxy-2,2,3-trimethylcyclobutyl)-N,2-dimethyl-3-(methylamino)propanamide;hydrochloride
SMILESCNCC(C)C(=O)N(C)C1CC(C)(OC)C1(C)C.Cl
InChIInChI=1S/C14H28N2O2.ClH/c1-10(9-15-5)12(17)16(6)11-8-14(4,18-7)13(11,2)3;/h10-11,15H,8-9H2,1-7H3;1H
InChIKeyKEMXNTVVRRMGKA-UHFFFAOYSA-N
XLogP1.93
TPSA41.57 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds5
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500292.85
LogP ≤ 51.93
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

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CID 64851156
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CID 64851731
CID 64851731
CID 64851764
CID 64851764
CID 64851765
CID 64851765
CID 64851770
CID 64851770
CID 65167589
CID 65167589
CID 65167590
CID 65167590
CID 65169493
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CID 65169602
CID 65169602

Frequently Asked Questions

What is the IUPAC name of N-(3-methoxy-2,2,3-trimethylcyclobutyl)-N,2-dimethyl-3-(methylamino)propanamide;hydrochloride?
The IUPAC name of N-(3-methoxy-2,2,3-trimethylcyclobutyl)-N,2-dimethyl-3-(methylamino)propanamide;hydrochloride (CID 119817564) is N-(3-methoxy-2,2,3-trimethylcyclobutyl)-N,2-dimethyl-3-(methylamino)propanamide;hydrochloride.
What is the SMILES notation for N-(3-methoxy-2,2,3-trimethylcyclobutyl)-N,2-dimethyl-3-(methylamino)propanamide;hydrochloride?
The canonical SMILES for N-(3-methoxy-2,2,3-trimethylcyclobutyl)-N,2-dimethyl-3-(methylamino)propanamide;hydrochloride is CNCC(C)C(=O)N(C)C1CC(C)(OC)C1(C)C.Cl.
What is the InChIKey of N-(3-methoxy-2,2,3-trimethylcyclobutyl)-N,2-dimethyl-3-(methylamino)propanamide;hydrochloride?
The InChIKey is KEMXNTVVRRMGKA-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H28N2O2.ClH/c1-10(9-15-5)12(17)16(6)11-8-14(4,18-7)13(11,2)3;/h10-11,15H,8-9H2,1-7H3;1H.
What are the key properties of N-(3-methoxy-2,2,3-trimethylcyclobutyl)-N,2-dimethyl-3-(methylamino)propanamide;hydrochloride?
N-(3-methoxy-2,2,3-trimethylcyclobutyl)-N,2-dimethyl-3-(methylamino)propanamide;hydrochloride has a molecular weight of 292.85 g/mol, XLogP of 1.93, 5 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-(3-methoxy-2,2,3-trimethylcyclobutyl)-N,2-dimethyl-3-(methylamino)propanamide;hydrochloride is sourced from PubChem (CID 119817564), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).