(3R)-N-(pyrimidin-5-ylmethyl)oxan-3-amine

C10H15N3O — CID 130660711

IUPAC(3R)-N-(pyrimidin-5-ylmethyl)oxan-3-amine
SMILESc1ncc(CN[C@@H]2CCCOC2)cn1
InChIInChI=1S/C10H15N3O/c1-2-10(7-14-3-1)13-6-9-4-11-8-12-5-9/h4-5,8,10,13H,1-3,6-7H2/t10-/m1/s1
InChIKeyLWYNLHAOWWGNHS-SNVBAGLBSA-N
MW193.25 g/mol
LogP0.75
Rot. Bonds3

About (3R)-N-(pyrimidin-5-ylmethyl)oxan-3-amine

(3R)-N-(pyrimidin-5-ylmethyl)oxan-3-amine (PubChem CID 130660711) has the molecular formula C10H15N3O and a molecular weight of 193.25 g/mol. Its IUPAC name is (3R)-N-(pyrimidin-5-ylmethyl)oxan-3-amine.

Molecular Properties

Compound Name(3R)-N-(pyrimidin-5-ylmethyl)oxan-3-amine
PubChem CID130660711
Molecular FormulaC10H15N3O
Molecular Weight193.25 g/mol
Exact Mass193.12
IUPAC Name(3R)-N-(pyrimidin-5-ylmethyl)oxan-3-amine
SMILESc1ncc(CN[C@@H]2CCCOC2)cn1
InChIInChI=1S/C10H15N3O/c1-2-10(7-14-3-1)13-6-9-4-11-8-12-5-9/h4-5,8,10,13H,1-3,6-7H2/t10-/m1/s1
InChIKeyLWYNLHAOWWGNHS-SNVBAGLBSA-N
XLogP0.75
TPSA47.04 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds3
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500193.25
LogP ≤ 50.75
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Related Compounds

(3S)-N-(1,3-thiazol-5-ylmethyl)oxan-3-amine
CID 130891979
N-(pyrimidin-4-ylmethyl)oxan-3-amine
CID 63360348
N-(1H-pyrrol-3-ylmethyl)oxan-3-amine
CID 66409421
(3S)-N-[(6-pyrrolidin-1-yl-3-pyridinyl)methyl]oxan-3-amine
CID 97224310
(3R)-N-[(5-bromo-1,3-thiazol-2-yl)methyl]oxan-3-amine
CID 126987035
N-[(4-methoxyphenyl)methyl]oxan-3-amine
CID 63360174
N-[(5-chloro-2-pyridinyl)methyl]oxan-3-amine
CID 115906683
N-[[4-(difluoromethyl)phenyl]methyl]oxan-3-amine
CID 113328356
(3S)-N-[(5-bromo-1,3-thiazol-2-yl)methyl]oxan-3-amine
CID 130646271
N-(pyridin-4-ylmethyl)oxolan-3-amine
CID 63331890
2-chloro-4-[(oxan-3-ylamino)methyl]phenol
CID 63363487
N-[[4-(diethylamino)phenyl]methyl]oxan-3-amine
CID 63360053

Frequently Asked Questions

What is the IUPAC name of (3R)-N-(pyrimidin-5-ylmethyl)oxan-3-amine?
The IUPAC name of (3R)-N-(pyrimidin-5-ylmethyl)oxan-3-amine (CID 130660711) is (3R)-N-(pyrimidin-5-ylmethyl)oxan-3-amine.
What is the SMILES notation for (3R)-N-(pyrimidin-5-ylmethyl)oxan-3-amine?
The canonical SMILES for (3R)-N-(pyrimidin-5-ylmethyl)oxan-3-amine is c1ncc(CN[C@@H]2CCCOC2)cn1.
What is the InChIKey of (3R)-N-(pyrimidin-5-ylmethyl)oxan-3-amine?
The InChIKey is LWYNLHAOWWGNHS-SNVBAGLBSA-N. The full InChI is InChI=1S/C10H15N3O/c1-2-10(7-14-3-1)13-6-9-4-11-8-12-5-9/h4-5,8,10,13H,1-3,6-7H2/t10-/m1/s1.
What are the key properties of (3R)-N-(pyrimidin-5-ylmethyl)oxan-3-amine?
(3R)-N-(pyrimidin-5-ylmethyl)oxan-3-amine has a molecular weight of 193.25 g/mol, XLogP of 0.75, 3 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for (3R)-N-(pyrimidin-5-ylmethyl)oxan-3-amine is sourced from PubChem (CID 130660711), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).