N-(pyrimidin-5-ylmethyl)hexan-2-amine

C11H19N3 — CID 62759376

IUPACN-(pyrimidin-5-ylmethyl)hexan-2-amine
SMILESCCCCC(C)NCc1cncnc1
InChIInChI=1S/C11H19N3/c1-3-4-5-10(2)14-8-11-6-12-9-13-7-11/h6-7,9-10,14H,3-5,8H2,1-2H3
InChIKeyQCFLUUCQGIKHFR-UHFFFAOYSA-N
MW193.29 g/mol
LogP2.14
Rot. Bonds6

About N-(pyrimidin-5-ylmethyl)hexan-2-amine

N-(pyrimidin-5-ylmethyl)hexan-2-amine (PubChem CID 62759376) has the molecular formula C11H19N3 and a molecular weight of 193.29 g/mol. Its IUPAC name is N-(pyrimidin-5-ylmethyl)hexan-2-amine.

Molecular Properties

Compound NameN-(pyrimidin-5-ylmethyl)hexan-2-amine
PubChem CID62759376
Molecular FormulaC11H19N3
Molecular Weight193.29 g/mol
Exact Mass193.16
IUPAC NameN-(pyrimidin-5-ylmethyl)hexan-2-amine
SMILESCCCCC(C)NCc1cncnc1
InChIInChI=1S/C11H19N3/c1-3-4-5-10(2)14-8-11-6-12-9-13-7-11/h6-7,9-10,14H,3-5,8H2,1-2H3
InChIKeyQCFLUUCQGIKHFR-UHFFFAOYSA-N
XLogP2.14
TPSA37.81 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds6
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500193.29
LogP ≤ 52.14
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

N-(pyrimidin-2-ylmethyl)hexan-2-amine
CID 62700861
(2R)-N-benzylheptan-2-amine
CID 14923313
N-[(4-methoxyphenyl)methyl]hexan-2-amine
CID 43760039
N-[(4-ethoxyphenyl)methyl]hexan-2-amine
CID 62197866
2,6-difluoro-4-[(hexan-2-ylamino)methyl]phenol
CID 79891666
N-[(5-fluoro-3-pyridinyl)methyl]pentan-2-amine
CID 104953314
4-[(hexan-2-ylamino)methyl]benzene-1,2-diol
CID 62196921
N-[(5-methylpyrazin-2-yl)methyl]hexan-2-amine
CID 62847900
N-[[4-(diethylaminomethyl)phenyl]methyl]hexan-2-amine
CID 43770019
N-[(1-phenylpyrazol-4-yl)methyl]hexan-2-amine
CID 62196925
N-[(4-imidazol-1-ylphenyl)methyl]hexan-2-amine
CID 62200953
N-(isoquinolin-6-ylmethyl)heptan-2-amine
CID 107037843

Frequently Asked Questions

What is the IUPAC name of N-(pyrimidin-5-ylmethyl)hexan-2-amine?
The IUPAC name of N-(pyrimidin-5-ylmethyl)hexan-2-amine (CID 62759376) is N-(pyrimidin-5-ylmethyl)hexan-2-amine.
What is the SMILES notation for N-(pyrimidin-5-ylmethyl)hexan-2-amine?
The canonical SMILES for N-(pyrimidin-5-ylmethyl)hexan-2-amine is CCCCC(C)NCc1cncnc1.
What is the InChIKey of N-(pyrimidin-5-ylmethyl)hexan-2-amine?
The InChIKey is QCFLUUCQGIKHFR-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H19N3/c1-3-4-5-10(2)14-8-11-6-12-9-13-7-11/h6-7,9-10,14H,3-5,8H2,1-2H3.
What are the key properties of N-(pyrimidin-5-ylmethyl)hexan-2-amine?
N-(pyrimidin-5-ylmethyl)hexan-2-amine has a molecular weight of 193.29 g/mol, XLogP of 2.14, 6 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-(pyrimidin-5-ylmethyl)hexan-2-amine is sourced from PubChem (CID 62759376), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).