N-[(1-methoxycyclobutyl)methyl]-2-propyloxan-4-amine

C14H27NO2 — CID 113362714

IUPACN-[(1-methoxycyclobutyl)methyl]-2-propyloxan-4-amine
SMILESCCCC1CC(NCC2(OC)CCC2)CCO1
InChIInChI=1S/C14H27NO2/c1-3-5-13-10-12(6-9-17-13)15-11-14(16-2)7-4-8-14/h12-13,15H,3-11H2,1-2H3
InChIKeyNSXSDNNJGBCWSB-UHFFFAOYSA-N
MW241.37 g/mol
LogP2.49
Rot. Bonds6

About N-[(1-methoxycyclobutyl)methyl]-2-propyloxan-4-amine

N-[(1-methoxycyclobutyl)methyl]-2-propyloxan-4-amine (PubChem CID 113362714) has the molecular formula C14H27NO2 and a molecular weight of 241.37 g/mol. Its IUPAC name is N-[(1-methoxycyclobutyl)methyl]-2-propyloxan-4-amine.

Molecular Properties

Compound NameN-[(1-methoxycyclobutyl)methyl]-2-propyloxan-4-amine
PubChem CID113362714
Molecular FormulaC14H27NO2
Molecular Weight241.37 g/mol
Exact Mass241.20
IUPAC NameN-[(1-methoxycyclobutyl)methyl]-2-propyloxan-4-amine
SMILESCCCC1CC(NCC2(OC)CCC2)CCO1
InChIInChI=1S/C14H27NO2/c1-3-5-13-10-12(6-9-17-13)15-11-14(16-2)7-4-8-14/h12-13,15H,3-11H2,1-2H3
InChIKeyNSXSDNNJGBCWSB-UHFFFAOYSA-N
XLogP2.49
TPSA30.49 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds6
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500241.37
LogP ≤ 52.49
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

4,4-dimethyl-1-[[(2-propyloxan-4-yl)amino]methyl]cyclohexan-1-ol
CID 65115439
N-[(1-methoxycyclobutyl)methyl]-4-propylcyclohexan-1-amine
CID 103991695
N-[(2,2-dimethylcyclopropyl)methyl]-2-propyloxan-4-amine
CID 103991250
N-(3-methyl-2-propan-2-ylbutyl)-2-propyloxan-4-amine
CID 102904715
2,6-dimethyl-N-(2-propyloxan-4-yl)piperidin-1-amine
CID 83007696
N-[2-(cyclopropylmethoxy)ethyl]-2-propyloxan-4-amine
CID 103991212
6-[(2-propyloxan-4-yl)amino]hexan-1-ol
CID 103991516
N-[(1-methylpyrrolidin-2-yl)methyl]-2-propyloxan-4-amine
CID 103991074
4-methyl-1-[(2-propyloxan-4-yl)amino]pentan-2-ol
CID 103991084
N-[(1-propoxycyclopentyl)methyl]cyclopropanamine
CID 62107293
3-methyl-4-[(2-propyloxan-4-yl)amino]butan-1-ol
CID 66091276
N-[2-(1-methylpiperidin-4-yl)ethyl]-2-propyloxan-4-amine
CID 103991149

Frequently Asked Questions

What is the IUPAC name of N-[(1-methoxycyclobutyl)methyl]-2-propyloxan-4-amine?
The IUPAC name of N-[(1-methoxycyclobutyl)methyl]-2-propyloxan-4-amine (CID 113362714) is N-[(1-methoxycyclobutyl)methyl]-2-propyloxan-4-amine.
What is the SMILES notation for N-[(1-methoxycyclobutyl)methyl]-2-propyloxan-4-amine?
The canonical SMILES for N-[(1-methoxycyclobutyl)methyl]-2-propyloxan-4-amine is CCCC1CC(NCC2(OC)CCC2)CCO1.
What is the InChIKey of N-[(1-methoxycyclobutyl)methyl]-2-propyloxan-4-amine?
The InChIKey is NSXSDNNJGBCWSB-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H27NO2/c1-3-5-13-10-12(6-9-17-13)15-11-14(16-2)7-4-8-14/h12-13,15H,3-11H2,1-2H3.
What are the key properties of N-[(1-methoxycyclobutyl)methyl]-2-propyloxan-4-amine?
N-[(1-methoxycyclobutyl)methyl]-2-propyloxan-4-amine has a molecular weight of 241.37 g/mol, XLogP of 2.49, 6 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-[(1-methoxycyclobutyl)methyl]-2-propyloxan-4-amine is sourced from PubChem (CID 113362714), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).