N-[(2-cyclopropyl-3-propyloxolan-3-yl)methyl]propan-2-amine

C14H27NO — CID 104509924

IUPACN-[(2-cyclopropyl-3-propyloxolan-3-yl)methyl]propan-2-amine
SMILESCCCC1(CNC(C)C)CCOC1C1CC1
InChIInChI=1S/C14H27NO/c1-4-7-14(10-15-11(2)3)8-9-16-13(14)12-5-6-12/h11-13,15H,4-10H2,1-3H3
InChIKeyYBCCEUOORGUYDW-UHFFFAOYSA-N
MW225.38 g/mol
LogP2.97
Rot. Bonds6

About N-[(2-cyclopropyl-3-propyloxolan-3-yl)methyl]propan-2-amine

N-[(2-cyclopropyl-3-propyloxolan-3-yl)methyl]propan-2-amine (PubChem CID 104509924) has the molecular formula C14H27NO and a molecular weight of 225.38 g/mol. Its IUPAC name is N-[(2-cyclopropyl-3-propyloxolan-3-yl)methyl]propan-2-amine.

Molecular Properties

Compound NameN-[(2-cyclopropyl-3-propyloxolan-3-yl)methyl]propan-2-amine
PubChem CID104509924
Molecular FormulaC14H27NO
Molecular Weight225.38 g/mol
Exact Mass225.21
IUPAC NameN-[(2-cyclopropyl-3-propyloxolan-3-yl)methyl]propan-2-amine
SMILESCCCC1(CNC(C)C)CCOC1C1CC1
InChIInChI=1S/C14H27NO/c1-4-7-14(10-15-11(2)3)8-9-16-13(14)12-5-6-12/h11-13,15H,4-10H2,1-3H3
InChIKeyYBCCEUOORGUYDW-UHFFFAOYSA-N
XLogP2.97
TPSA21.26 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds6
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500225.38
LogP ≤ 52.97
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Related Compounds

N-[(2-cyclopropyl-3-hexyloxolan-3-yl)methyl]propan-2-amine
CID 104509877
N-[[2-cyclopropyl-3-(2-thiophen-2-ylethyl)oxolan-3-yl]methyl]propan-2-amine
CID 104509867
1-[2-cyclopropyl-3-(3-methylbutyl)oxolan-3-yl]-N-methylmethanamine
CID 104509569
N-[[2-cyclopropyl-3-(trimethylsilylmethyl)oxolan-3-yl]methyl]propan-1-amine
CID 106323947
N-[[2-cyclopropyl-3-[2-(2-methylpropoxy)ethyl]oxolan-3-yl]methyl]cyclopropanamine
CID 106457296
N-[[2-cyclopropyl-3-(2-ethoxyethyl)oxolan-3-yl]methyl]cyclopropanamine
CID 113420877
[2-cyclopropyl-3-(2-methylpentyl)oxolan-3-yl]methanol
CID 104510505
2-cyclopropyl-3-propyloxolan-3-amine
CID 104510271
N-[[2-cyclopropyl-3-(3-ethoxypropyl)oxolan-3-yl]methyl]cyclopropanamine
CID 104510013
N-[[2-cyclopropyl-3-(2-methylpropyl)oxolan-3-yl]methyl]-2-methoxyethanamine
CID 104510154
N-[[2-cyclopropyl-3-(3-methylsulfonylpropyl)oxolan-3-yl]methyl]-2-methylpropan-1-amine
CID 104510106
N-[[3-(3-ethylsulfonylpropyl)-2-methyloxolan-3-yl]methyl]propan-2-amine
CID 114534670

Frequently Asked Questions

What is the IUPAC name of N-[(2-cyclopropyl-3-propyloxolan-3-yl)methyl]propan-2-amine?
The IUPAC name of N-[(2-cyclopropyl-3-propyloxolan-3-yl)methyl]propan-2-amine (CID 104509924) is N-[(2-cyclopropyl-3-propyloxolan-3-yl)methyl]propan-2-amine.
What is the SMILES notation for N-[(2-cyclopropyl-3-propyloxolan-3-yl)methyl]propan-2-amine?
The canonical SMILES for N-[(2-cyclopropyl-3-propyloxolan-3-yl)methyl]propan-2-amine is CCCC1(CNC(C)C)CCOC1C1CC1.
What is the InChIKey of N-[(2-cyclopropyl-3-propyloxolan-3-yl)methyl]propan-2-amine?
The InChIKey is YBCCEUOORGUYDW-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H27NO/c1-4-7-14(10-15-11(2)3)8-9-16-13(14)12-5-6-12/h11-13,15H,4-10H2,1-3H3.
What are the key properties of N-[(2-cyclopropyl-3-propyloxolan-3-yl)methyl]propan-2-amine?
N-[(2-cyclopropyl-3-propyloxolan-3-yl)methyl]propan-2-amine has a molecular weight of 225.38 g/mol, XLogP of 2.97, 6 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N-[(2-cyclopropyl-3-propyloxolan-3-yl)methyl]propan-2-amine is sourced from PubChem (CID 104509924), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).