2-(cyclopropylmethoxymethyl)-N-(2-methoxyethyl)-2-methylpentan-1-amine

C14H29NO2 — CID 106930750

IUPAC2-(cyclopropylmethoxymethyl)-N-(2-methoxyethyl)-2-methylpentan-1-amine
SMILESCCCC(C)(CNCCOC)COCC1CC1
InChIInChI=1S/C14H29NO2/c1-4-7-14(2,11-15-8-9-16-3)12-17-10-13-5-6-13/h13,15H,4-12H2,1-3H3
InChIKeyPFYIZLVPXFTNEB-UHFFFAOYSA-N
MW243.39 g/mol
LogP2.46
Rot. Bonds11

About 2-(cyclopropylmethoxymethyl)-N-(2-methoxyethyl)-2-methylpentan-1-amine

2-(cyclopropylmethoxymethyl)-N-(2-methoxyethyl)-2-methylpentan-1-amine (PubChem CID 106930750) has the molecular formula C14H29NO2 and a molecular weight of 243.39 g/mol. Its IUPAC name is 2-(cyclopropylmethoxymethyl)-N-(2-methoxyethyl)-2-methylpentan-1-amine.

Molecular Properties

Compound Name2-(cyclopropylmethoxymethyl)-N-(2-methoxyethyl)-2-methylpentan-1-amine
PubChem CID106930750
Molecular FormulaC14H29NO2
Molecular Weight243.39 g/mol
Exact Mass243.22
IUPAC Name2-(cyclopropylmethoxymethyl)-N-(2-methoxyethyl)-2-methylpentan-1-amine
SMILESCCCC(C)(CNCCOC)COCC1CC1
InChIInChI=1S/C14H29NO2/c1-4-7-14(2,11-15-8-9-16-3)12-17-10-13-5-6-13/h13,15H,4-12H2,1-3H3
InChIKeyPFYIZLVPXFTNEB-UHFFFAOYSA-N
XLogP2.46
TPSA30.49 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds11
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500243.39
LogP ≤ 52.46
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'Aliphatic_long_chain', 'substructure': 'N/A'}

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Related Compounds

N-[2-(cyclopropylmethoxymethyl)-2-methylpentyl]cyclopropanamine
CID 106930748
N-(2-methoxyethyl)-2,5,5-trimethyl-2-propylhexan-1-amine
CID 55196240
4-ethyl-N-(2-methoxyethyl)-2-methyl-2-propylhexan-1-amine
CID 82929981
2-benzyl-N-(2-methoxyethyl)-2-methylpentan-1-amine
CID 62726236
N-(2-methoxyethyl)-2,6-dimethyl-2-propylheptan-1-amine
CID 83168794
2-[(4-fluorophenyl)methyl]-N-(2-methoxyethyl)-2-methylpentan-1-amine
CID 62724025
6-methoxy-2-methyl-N,2-dipropylhexan-1-amine
CID 104649332
2-[(3,3-difluorocyclopentyl)methyl]-N-(2-methoxyethyl)-2-methylbutan-1-amine
CID 114225119
2-cyclopropyl-2-ethyl-N-(2-methoxyethyl)hexan-1-amine
CID 104819386
N-(cyclopropylmethyl)-2-methoxyethanamine
CID 19353678
N-[(4-butylcyclohexyl)methyl]-2-methoxyethanamine
CID 62542657
2-cyclopropyl-N-(2-methoxyethyl)-2-methyldecan-1-amine
CID 83160454

Frequently Asked Questions

What is the IUPAC name of 2-(cyclopropylmethoxymethyl)-N-(2-methoxyethyl)-2-methylpentan-1-amine?
The IUPAC name of 2-(cyclopropylmethoxymethyl)-N-(2-methoxyethyl)-2-methylpentan-1-amine (CID 106930750) is 2-(cyclopropylmethoxymethyl)-N-(2-methoxyethyl)-2-methylpentan-1-amine.
What is the SMILES notation for 2-(cyclopropylmethoxymethyl)-N-(2-methoxyethyl)-2-methylpentan-1-amine?
The canonical SMILES for 2-(cyclopropylmethoxymethyl)-N-(2-methoxyethyl)-2-methylpentan-1-amine is CCCC(C)(CNCCOC)COCC1CC1.
What is the InChIKey of 2-(cyclopropylmethoxymethyl)-N-(2-methoxyethyl)-2-methylpentan-1-amine?
The InChIKey is PFYIZLVPXFTNEB-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H29NO2/c1-4-7-14(2,11-15-8-9-16-3)12-17-10-13-5-6-13/h13,15H,4-12H2,1-3H3.
What are the key properties of 2-(cyclopropylmethoxymethyl)-N-(2-methoxyethyl)-2-methylpentan-1-amine?
2-(cyclopropylmethoxymethyl)-N-(2-methoxyethyl)-2-methylpentan-1-amine has a molecular weight of 243.39 g/mol, XLogP of 2.46, 11 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(cyclopropylmethoxymethyl)-N-(2-methoxyethyl)-2-methylpentan-1-amine is sourced from PubChem (CID 106930750), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).