3-methoxy-2,2-dimethyl-N-(5-methylheptan-3-yl)cyclobutan-1-amine

C15H31NO — CID 114118592

IUPAC3-methoxy-2,2-dimethyl-N-(5-methylheptan-3-yl)cyclobutan-1-amine
SMILESCCC(C)CC(CC)NC1CC(OC)C1(C)C
InChIInChI=1S/C15H31NO/c1-7-11(3)9-12(8-2)16-13-10-14(17-6)15(13,4)5/h11-14,16H,7-10H2,1-6H3
InChIKeyTZHOAZHMTQOAND-UHFFFAOYSA-N
MW241.42 g/mol
LogP3.60
Rot. Bonds7

About 3-methoxy-2,2-dimethyl-N-(5-methylheptan-3-yl)cyclobutan-1-amine

3-methoxy-2,2-dimethyl-N-(5-methylheptan-3-yl)cyclobutan-1-amine (PubChem CID 114118592) has the molecular formula C15H31NO and a molecular weight of 241.42 g/mol. Its IUPAC name is 3-methoxy-2,2-dimethyl-N-(5-methylheptan-3-yl)cyclobutan-1-amine.

Molecular Properties

Compound Name3-methoxy-2,2-dimethyl-N-(5-methylheptan-3-yl)cyclobutan-1-amine
PubChem CID114118592
Molecular FormulaC15H31NO
Molecular Weight241.42 g/mol
Exact Mass241.24
IUPAC Name3-methoxy-2,2-dimethyl-N-(5-methylheptan-3-yl)cyclobutan-1-amine
SMILESCCC(C)CC(CC)NC1CC(OC)C1(C)C
InChIInChI=1S/C15H31NO/c1-7-11(3)9-12(8-2)16-13-10-14(17-6)15(13,4)5/h11-14,16H,7-10H2,1-6H3
InChIKeyTZHOAZHMTQOAND-UHFFFAOYSA-N
XLogP3.60
TPSA21.26 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds7
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500241.42
LogP ≤ 53.60
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Related Compounds

3-methoxy-N-(3-methoxybutan-2-yl)-2,2-dimethylcyclobutan-1-amine
CID 103788439
N-(dicyclopropylmethyl)-3-methoxy-2,2-dimethylcyclobutan-1-amine
CID 103788373
3-methoxy-N-[1-(2-methoxyphenyl)propyl]-2,2-dimethylcyclobutan-1-amine
CID 103788453
3-methoxy-2,2-dimethyl-N-propylcyclobutan-1-amine
CID 66357970
3-methoxy-N,2,2-trimethylcyclobutan-1-amine
CID 66357766
3-methoxy-2,2-dimethyl-N-(6,6,6-trifluorohexan-2-yl)cyclobutan-1-amine
CID 104924983
N-(3-methoxy-2,2-dimethylcyclobutyl)-2-(propan-2-ylamino)ethanesulfonamide
CID 114120022
(2S)-2-amino-N-(3-methoxy-2,2-dimethylcyclobutyl)-4-methylpentanamide
CID 103812819
1-ethyl-3-(3-methoxy-2,2-dimethylcyclobutyl)thiourea
CID 103742080
(2R)-2-amino-N-(3-methoxy-2,2-dimethylcyclobutyl)propanamide
CID 103797993
N-[1-(4-bromothiophen-2-yl)ethyl]-3-methoxy-2,2-dimethylcyclobutan-1-amine
CID 107167528
2-[(3-methoxy-2,2-dimethylcyclobutyl)amino]-1-morpholin-4-ylpropan-1-one
CID 103742148

Frequently Asked Questions

What is the IUPAC name of 3-methoxy-2,2-dimethyl-N-(5-methylheptan-3-yl)cyclobutan-1-amine?
The IUPAC name of 3-methoxy-2,2-dimethyl-N-(5-methylheptan-3-yl)cyclobutan-1-amine (CID 114118592) is 3-methoxy-2,2-dimethyl-N-(5-methylheptan-3-yl)cyclobutan-1-amine.
What is the SMILES notation for 3-methoxy-2,2-dimethyl-N-(5-methylheptan-3-yl)cyclobutan-1-amine?
The canonical SMILES for 3-methoxy-2,2-dimethyl-N-(5-methylheptan-3-yl)cyclobutan-1-amine is CCC(C)CC(CC)NC1CC(OC)C1(C)C.
What is the InChIKey of 3-methoxy-2,2-dimethyl-N-(5-methylheptan-3-yl)cyclobutan-1-amine?
The InChIKey is TZHOAZHMTQOAND-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H31NO/c1-7-11(3)9-12(8-2)16-13-10-14(17-6)15(13,4)5/h11-14,16H,7-10H2,1-6H3.
What are the key properties of 3-methoxy-2,2-dimethyl-N-(5-methylheptan-3-yl)cyclobutan-1-amine?
3-methoxy-2,2-dimethyl-N-(5-methylheptan-3-yl)cyclobutan-1-amine has a molecular weight of 241.42 g/mol, XLogP of 3.60, 7 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 3-methoxy-2,2-dimethyl-N-(5-methylheptan-3-yl)cyclobutan-1-amine is sourced from PubChem (CID 114118592), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).