N-ethyl-N-propyloxan-2-amine

C10H21NO — CID 90739816

IUPACN-ethyl-N-propyloxan-2-amine
SMILESCCCN(CC)C1CCCCO1
InChIInChI=1S/C10H21NO/c1-3-8-11(4-2)10-7-5-6-9-12-10/h10H,3-9H2,1-2H3
InChIKeyYVWZOGGFXIQKOY-UHFFFAOYSA-N
MW171.28 g/mol
LogP2.24
Rot. Bonds4

About N-ethyl-N-propyloxan-2-amine

N-ethyl-N-propyloxan-2-amine (PubChem CID 90739816) has the molecular formula C10H21NO and a molecular weight of 171.28 g/mol. Its IUPAC name is N-ethyl-N-propyloxan-2-amine.

Molecular Properties

Compound NameN-ethyl-N-propyloxan-2-amine
PubChem CID90739816
Molecular FormulaC10H21NO
Molecular Weight171.28 g/mol
Exact Mass171.16
IUPAC NameN-ethyl-N-propyloxan-2-amine
SMILESCCCN(CC)C1CCCCO1
InChIInChI=1S/C10H21NO/c1-3-8-11(4-2)10-7-5-6-9-12-10/h10H,3-9H2,1-2H3
InChIKeyYVWZOGGFXIQKOY-UHFFFAOYSA-N
XLogP2.24
TPSA12.47 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds4
Heavy Atoms12
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500171.28
LogP ≤ 52.24
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

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Related Compounds

N-butyl-N-propyloxan-2-amine
CID 91513495
N-methyl-N-propyloxan-2-amine
CID 91002672
N'-[3-(dimethylamino)propyl]-N,N-dimethyl-N'-(oxan-2-yl)propane-1,3-diamine
CID 174963447
(2R)-N,N-dimethyloxan-2-amine
CID 92983084
N-methyl-N-(oxan-2-ylmethyl)propan-1-amine
CID 169307436
N-methyl-N-(oxepan-2-ylmethyl)propan-1-amine
CID 169307437
N,N-dipropylcyclodecanamine
CID 139723962
methyl 2-[oxane-2-carbonyl(propyl)amino]acetate
CID 62213195
4-N-ethyl-4-N-(oxan-2-ylmethyl)cyclohexane-1,4-diamine
CID 79115797
2-methyloxane;propane
CID 171074580
N-methyl-N-(oxocan-4-ylmethyl)propan-1-amine
CID 169307485
N-(oxolan-2-ylmethyl)-N-propylpiperidin-4-amine
CID 60806655

Frequently Asked Questions

What is the IUPAC name of N-ethyl-N-propyloxan-2-amine?
The IUPAC name of N-ethyl-N-propyloxan-2-amine (CID 90739816) is N-ethyl-N-propyloxan-2-amine.
What is the SMILES notation for N-ethyl-N-propyloxan-2-amine?
The canonical SMILES for N-ethyl-N-propyloxan-2-amine is CCCN(CC)C1CCCCO1.
What is the InChIKey of N-ethyl-N-propyloxan-2-amine?
The InChIKey is YVWZOGGFXIQKOY-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H21NO/c1-3-8-11(4-2)10-7-5-6-9-12-10/h10H,3-9H2,1-2H3.
What are the key properties of N-ethyl-N-propyloxan-2-amine?
N-ethyl-N-propyloxan-2-amine has a molecular weight of 171.28 g/mol, XLogP of 2.24, 4 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N-ethyl-N-propyloxan-2-amine is sourced from PubChem (CID 90739816), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).