N,2-dimethyl-N-(morpholin-2-ylmethyl)-5-propan-2-ylaniline

C16H26N2O — CID 115237568

IUPACN,2-dimethyl-N-(morpholin-2-ylmethyl)-5-propan-2-ylaniline
SMILESCc1ccc(C(C)C)cc1N(C)CC1CNCCO1
InChIInChI=1S/C16H26N2O/c1-12(2)14-6-5-13(3)16(9-14)18(4)11-15-10-17-7-8-19-15/h5-6,9,12,15,17H,7-8,10-11H2,1-4H3
InChIKeyATMCVPAKXYZSQJ-UHFFFAOYSA-N
MW262.40 g/mol
LogP2.54
Rot. Bonds4

About N,2-dimethyl-N-(morpholin-2-ylmethyl)-5-propan-2-ylaniline

N,2-dimethyl-N-(morpholin-2-ylmethyl)-5-propan-2-ylaniline (PubChem CID 115237568) has the molecular formula C16H26N2O and a molecular weight of 262.40 g/mol. Its IUPAC name is N,2-dimethyl-N-(morpholin-2-ylmethyl)-5-propan-2-ylaniline.

Molecular Properties

Compound NameN,2-dimethyl-N-(morpholin-2-ylmethyl)-5-propan-2-ylaniline
PubChem CID115237568
Molecular FormulaC16H26N2O
Molecular Weight262.40 g/mol
Exact Mass262.20
IUPAC NameN,2-dimethyl-N-(morpholin-2-ylmethyl)-5-propan-2-ylaniline
SMILESCc1ccc(C(C)C)cc1N(C)CC1CNCCO1
InChIInChI=1S/C16H26N2O/c1-12(2)14-6-5-13(3)16(9-14)18(4)11-15-10-17-7-8-19-15/h5-6,9,12,15,17H,7-8,10-11H2,1-4H3
InChIKeyATMCVPAKXYZSQJ-UHFFFAOYSA-N
XLogP2.54
TPSA24.50 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds4
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500262.40
LogP ≤ 52.54
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

N,6-dimethyl-N-(morpholin-2-ylmethyl)-1,3-benzodioxol-5-amine
CID 115237589
N-methyl-N-(morpholin-2-ylmethyl)-5-propan-2-ylpyrimidin-2-amine
CID 116978150
2-[2-(2-methyl-5-propan-2-ylphenyl)ethyl]morpholine
CID 116868516
5-chloro-N,2-dimethyl-N-(morpholin-2-ylmethyl)-4-nitroaniline
CID 115556156
N-methyl-N-(2-methyl-5-propan-2-ylphenyl)pyrrolidin-3-amine
CID 115118743
4-methoxy-N,3,5-trimethyl-N-(morpholin-2-ylmethyl)aniline
CID 115237588
N-(chloromethyl)-N,2-dimethyl-5-propan-2-ylaniline
CID 115262883
N-methyl-4-methylsulfanyl-N-(morpholin-2-ylmethyl)aniline
CID 115237571
N-methyl-1-(2-methyl-5-propan-2-ylphenyl)-1-morpholin-2-ylmethanamine
CID 116956461
N-[[4-(difluoromethyl)phenyl]methyl]-N-methyl-1-morpholin-2-ylmethanamine
CID 115524679
N-methyl-1-morpholin-2-yl-N-[(2,3,4-trimethylphenyl)methyl]methanamine
CID 115237692
N-methyl-N-(morpholin-2-ylmethyl)-2-nitropyridin-3-amine
CID 104540927

Frequently Asked Questions

What is the IUPAC name of N,2-dimethyl-N-(morpholin-2-ylmethyl)-5-propan-2-ylaniline?
The IUPAC name of N,2-dimethyl-N-(morpholin-2-ylmethyl)-5-propan-2-ylaniline (CID 115237568) is N,2-dimethyl-N-(morpholin-2-ylmethyl)-5-propan-2-ylaniline.
What is the SMILES notation for N,2-dimethyl-N-(morpholin-2-ylmethyl)-5-propan-2-ylaniline?
The canonical SMILES for N,2-dimethyl-N-(morpholin-2-ylmethyl)-5-propan-2-ylaniline is Cc1ccc(C(C)C)cc1N(C)CC1CNCCO1.
What is the InChIKey of N,2-dimethyl-N-(morpholin-2-ylmethyl)-5-propan-2-ylaniline?
The InChIKey is ATMCVPAKXYZSQJ-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H26N2O/c1-12(2)14-6-5-13(3)16(9-14)18(4)11-15-10-17-7-8-19-15/h5-6,9,12,15,17H,7-8,10-11H2,1-4H3.
What are the key properties of N,2-dimethyl-N-(morpholin-2-ylmethyl)-5-propan-2-ylaniline?
N,2-dimethyl-N-(morpholin-2-ylmethyl)-5-propan-2-ylaniline has a molecular weight of 262.40 g/mol, XLogP of 2.54, 4 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N,2-dimethyl-N-(morpholin-2-ylmethyl)-5-propan-2-ylaniline is sourced from PubChem (CID 115237568), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).