N-[[5-(cyclopentylmethoxymethyl)oxolan-2-yl]methyl]-2-methylpropan-1-amine

C16H31NO2 — CID 66321864

IUPACN-[[5-(cyclopentylmethoxymethyl)oxolan-2-yl]methyl]-2-methylpropan-1-amine
SMILESCC(C)CNCC1CCC(COCC2CCCC2)O1
InChIInChI=1S/C16H31NO2/c1-13(2)9-17-10-15-7-8-16(19-15)12-18-11-14-5-3-4-6-14/h13-17H,3-12H2,1-2H3
InChIKeyGOQDSDLURSQSFK-UHFFFAOYSA-N
MW269.43 g/mol
LogP2.99
Rot. Bonds8

About N-[[5-(cyclopentylmethoxymethyl)oxolan-2-yl]methyl]-2-methylpropan-1-amine

N-[[5-(cyclopentylmethoxymethyl)oxolan-2-yl]methyl]-2-methylpropan-1-amine (PubChem CID 66321864) has the molecular formula C16H31NO2 and a molecular weight of 269.43 g/mol. Its IUPAC name is N-[[5-(cyclopentylmethoxymethyl)oxolan-2-yl]methyl]-2-methylpropan-1-amine.

Molecular Properties

Compound NameN-[[5-(cyclopentylmethoxymethyl)oxolan-2-yl]methyl]-2-methylpropan-1-amine
PubChem CID66321864
Molecular FormulaC16H31NO2
Molecular Weight269.43 g/mol
Exact Mass269.24
IUPAC NameN-[[5-(cyclopentylmethoxymethyl)oxolan-2-yl]methyl]-2-methylpropan-1-amine
SMILESCC(C)CNCC1CCC(COCC2CCCC2)O1
InChIInChI=1S/C16H31NO2/c1-13(2)9-17-10-15-7-8-16(19-15)12-18-11-14-5-3-4-6-14/h13-17H,3-12H2,1-2H3
InChIKeyGOQDSDLURSQSFK-UHFFFAOYSA-N
XLogP2.99
TPSA30.49 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds8
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500269.43
LogP ≤ 52.99
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

N-[[5-(cyclohexylmethoxymethyl)oxolan-2-yl]methyl]-2-methylpropan-1-amine
CID 62486552
2-methyl-N-[[5-(propan-2-yloxymethyl)oxolan-2-yl]methyl]propan-1-amine
CID 62458043
N-[[5-(cyclopropylmethoxymethyl)oxolan-2-yl]methyl]ethanamine
CID 62457821
N-methyl-N-[2-[[5-[(2-methylpropylamino)methyl]oxolan-2-yl]methoxy]ethyl]cyclopropanamine
CID 102740783
2-methyl-N-[[5-[2-(1-methylpyrrolidin-2-yl)ethoxymethyl]oxolan-2-yl]methyl]propan-1-amine
CID 62460799
N-[[5-(cyclopentylmethoxymethyl)oxolan-2-yl]methyl]-2-methylpropan-2-amine
CID 66324414
6-(cyclopentylmethoxy)-N-(2-methylpropyl)hexan-1-amine
CID 66321215
N-[[5-[(4-bromophenoxy)methyl]oxolan-2-yl]methyl]-2-methylpropan-1-amine
CID 62454415
N-[[5-[(2,4-dimethylphenoxy)methyl]oxolan-2-yl]methyl]-2-methylpropan-1-amine
CID 62453470
N-[[5-[(2,3-dimethylphenoxy)methyl]oxolan-2-yl]methyl]-2-methylpropan-1-amine
CID 62453326
N,4-dimethyl-N-[[5-[(2-methylpropylamino)methyl]oxolan-2-yl]methyl]pentan-2-amine
CID 62461429
N-methyl-1-[5-(2-methylpropoxymethyl)oxolan-2-yl]methanamine
CID 62444755

Frequently Asked Questions

What is the IUPAC name of N-[[5-(cyclopentylmethoxymethyl)oxolan-2-yl]methyl]-2-methylpropan-1-amine?
The IUPAC name of N-[[5-(cyclopentylmethoxymethyl)oxolan-2-yl]methyl]-2-methylpropan-1-amine (CID 66321864) is N-[[5-(cyclopentylmethoxymethyl)oxolan-2-yl]methyl]-2-methylpropan-1-amine.
What is the SMILES notation for N-[[5-(cyclopentylmethoxymethyl)oxolan-2-yl]methyl]-2-methylpropan-1-amine?
The canonical SMILES for N-[[5-(cyclopentylmethoxymethyl)oxolan-2-yl]methyl]-2-methylpropan-1-amine is CC(C)CNCC1CCC(COCC2CCCC2)O1.
What is the InChIKey of N-[[5-(cyclopentylmethoxymethyl)oxolan-2-yl]methyl]-2-methylpropan-1-amine?
The InChIKey is GOQDSDLURSQSFK-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H31NO2/c1-13(2)9-17-10-15-7-8-16(19-15)12-18-11-14-5-3-4-6-14/h13-17H,3-12H2,1-2H3.
What are the key properties of N-[[5-(cyclopentylmethoxymethyl)oxolan-2-yl]methyl]-2-methylpropan-1-amine?
N-[[5-(cyclopentylmethoxymethyl)oxolan-2-yl]methyl]-2-methylpropan-1-amine has a molecular weight of 269.43 g/mol, XLogP of 2.99, 8 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-[[5-(cyclopentylmethoxymethyl)oxolan-2-yl]methyl]-2-methylpropan-1-amine is sourced from PubChem (CID 66321864), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).